N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine

C38H33N — CID 155393699

IUPACN-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine
SMILESc1ccc(N(c2ccc3c(c2)C2(c4ccccc4-3)C3CC4CC(C3)CC2C4)c2cccc3ccccc23)cc1
InChIInChI=1S/C38H33N/c1-2-11-30(12-3-1)39(37-16-8-10-27-9-4-5-13-32(27)37)31-17-18-34-33-14-6-7-15-35(33)38(36(34)24-31)28-20-25-19-26(22-28)23-29(38)21-25/h1-18,24-26,28-29H,19-23H2
InChIKeyRLWOAIULQHYGRV-UHFFFAOYSA-N
MW503.69 g/mol
LogP10.03
Rot. Bonds3

About N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine

N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine (PubChem CID 155393699) has the molecular formula C38H33N and a molecular weight of 503.69 g/mol. Its IUPAC name is N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine
PubChem CID155393699
Molecular FormulaC38H33N
Molecular Weight503.69 g/mol
Exact Mass503.26
IUPAC NameN-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine
SMILESc1ccc(N(c2ccc3c(c2)C2(c4ccccc4-3)C3CC4CC(C3)CC2C4)c2cccc3ccccc23)cc1
InChIInChI=1S/C38H33N/c1-2-11-30(12-3-1)39(37-16-8-10-27-9-4-5-13-32(27)37)31-17-18-34-33-14-6-7-15-35(33)38(36(34)24-31)28-20-25-19-26(22-28)23-29(38)21-25/h1-18,24-26,28-29H,19-23H2
InChIKeyRLWOAIULQHYGRV-UHFFFAOYSA-N
XLogP10.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500503.69
LogP ≤ 510.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-naphthalen-1-yl-N-(4-phenylnaphthalen-1-yl)spiro[adamantane-2,9'-fluorene]-2'-amine
CID 155399556
9,9-dimethyl-N-naphthalen-1-yl-N-[4-[2-[4-(N-phenylanilino)phenyl]-2-adamantyl]phenyl]fluoren-2-amine
CID 168744605
N-phenanthren-2-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine
CID 155399590
N-(4-phenanthren-9-ylphenyl)-N-(2-phenylphenyl)spiro[adamantane-2,9'-fluorene]-2'-amine
CID 155393870
N-(4-naphthalen-1-ylphenyl)-N-spiro[adamantane-2,9'-fluorene]-2'-ylspiro[adamantane-2,9'-fluorene]-4'-amine
CID 168722937
N-phenanthren-2-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-2'-amine
CID 155393603
N-phenyl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-2'-amine
CID 155393636
N-phenyl-N-spiro[fluorene-9,2'-tricyclo[4.3.1.13,8]undecane]-1-ylspiro[fluorene-9,2'-tricyclo[4.3.1.13,8]undecane]-2-amine
CID 168722546
N-naphthalen-1-yl-N-spiro[bicyclo[2.2.1]heptane-2,9'-fluorene]-2'-ylspiro[fluorene-9,2'-tricyclo[4.3.1.13,8]undecane]-3-amine
CID 168722690
N-naphthalen-2-yl-N-spiro[adamantane-2,9'-fluorene]-2'-ylspiro[adamantane-2,9'-fluorene]-4'-amine
CID 168722460
N-[2-(9,9-dimethylfluoren-1-yl)phenyl]-N-phenanthren-2-ylspiro[adamantane-2,9'-fluorene]-2'-amine
CID 170217241
N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-1-ylphenyl)spiro[adamantane-2,9'-fluorene]-2'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenanthren-9-ylspiro[adamantane-2,9'-fluorene]-2'-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylnaphthalen-1-yl)spiro[adamantane-2,9'-fluorene]-2'-amine
CID 158875023

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine?
The IUPAC name of N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine (CID 155393699) is N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine.
What is the SMILES notation for N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine?
The canonical SMILES for N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine is c1ccc(N(c2ccc3c(c2)C2(c4ccccc4-3)C3CC4CC(C3)CC2C4)c2cccc3ccccc23)cc1.
What is the InChIKey of N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine?
The InChIKey is RLWOAIULQHYGRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H33N/c1-2-11-30(12-3-1)39(37-16-8-10-27-9-4-5-13-32(27)37)31-17-18-34-33-14-6-7-15-35(33)38(36(34)24-31)28-20-25-19-26(22-28)23-29(38)21-25/h1-18,24-26,28-29H,19-23H2.
What are the key properties of N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine?
N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine has a molecular weight of 503.69 g/mol, XLogP of 10.03, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine is sourced from PubChem (CID 155393699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).