N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine

C18H25N — CID 123398082

IUPACN-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine
SMILESCCNC(CC)(c1cccc2ccccc12)C(C)C
InChIInChI=1S/C18H25N/c1-5-18(14(3)4,19-6-2)17-13-9-11-15-10-7-8-12-16(15)17/h7-14,19H,5-6H2,1-4H3
InChIKeyHIJRSTJFAHQELD-UHFFFAOYSA-N
MW255.41 g/mol
LogP4.71
Rot. Bonds5

About N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine

N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine (PubChem CID 123398082) has the molecular formula C18H25N and a molecular weight of 255.41 g/mol. Its IUPAC name is N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine
PubChem CID123398082
Molecular FormulaC18H25N
Molecular Weight255.41 g/mol
Exact Mass255.20
IUPAC NameN-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine
SMILESCCNC(CC)(c1cccc2ccccc12)C(C)C
InChIInChI=1S/C18H25N/c1-5-18(14(3)4,19-6-2)17-13-9-11-15-10-7-8-12-16(15)17/h7-14,19H,5-6H2,1-4H3
InChIKeyHIJRSTJFAHQELD-UHFFFAOYSA-N
XLogP4.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-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

3-methyl-2-naphthalen-1-ylbutan-2-ol
CID 11830817
3-methyl-3-naphthalen-1-yl-N-propan-2-ylbutan-1-amine
CID 79830054
1-(1,1-dinaphthalen-1-ylethyl)naphthalene
CID 91541516
N,N-dimethyl-2-naphthalen-1-yl-2-propan-2-ylbutane-1,4-diamine
CID 53431573
N,4-dimethyl-4-naphthalen-1-ylpentan-2-amine
CID 64718281
1-(1,1-dichloro-2-methyldecyl)naphthalene
CID 151559313
1,1-difluoro-1-naphthalen-1-ylpropan-2-amine
CID 116839348
1-(1,1,1-trifluoro-2-methylbutan-2-yl)naphthalene
CID 118544454
(2S)-2-ethyl-N',N'-dimethyl-2-naphthalen-1-ylbutane-1,4-diamine
CID 125479768
1-(2,4-dimethylpentan-3-yl)naphthalene;1-(2,4-dimethyl-3-propan-2-ylpentan-3-yl)naphthalene
CID 173312876
(2R)-N'-ethyl-N'-methyl-2-naphthalen-1-yl-2-propan-2-ylbutane-1,4-diamine
CID 125480014
(2S)-2-[(2S)-butan-2-yl]-N',N'-dimethyl-2-naphthalen-1-ylbutane-1,4-diamine
CID 125480001

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine?
The IUPAC name of N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine (CID 123398082) is N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine.
What is the SMILES notation for N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine?
The canonical SMILES for N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine is CCNC(CC)(c1cccc2ccccc12)C(C)C.
What is the InChIKey of N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine?
The InChIKey is HIJRSTJFAHQELD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N/c1-5-18(14(3)4,19-6-2)17-13-9-11-15-10-7-8-12-16(15)17/h7-14,19H,5-6H2,1-4H3.
What are the key properties of N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine?
N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine has a molecular weight of 255.41 g/mol, XLogP of 4.71, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-3-naphthalen-1-ylpentan-3-amine is sourced from PubChem (CID 123398082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).