N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine

C15H20N2 — CID 54383683

IUPACN-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine
SMILESCCCNC1C=c2[nH]c3c(c2CC1)C=CCC=3
InChIInChI=1S/C15H20N2/c1-2-9-16-11-7-8-13-12-5-3-4-6-14(12)17-15(13)10-11/h3,5-6,10-11,16-17H,2,4,7-9H2,1H3
InChIKeyVBSQHCWHVNMBKB-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.31
Rot. Bonds3

About N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine

N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine (PubChem CID 54383683) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine.

Molecular Properties

Compound NameN-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine
PubChem CID54383683
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC NameN-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine
SMILESCCCNC1C=c2[nH]c3c(c2CC1)C=CCC=3
InChIInChI=1S/C15H20N2/c1-2-9-16-11-7-8-13-12-5-3-4-6-14(12)17-15(13)10-11/h3,5-6,10-11,16-17H,2,4,7-9H2,1H3
InChIKeyVBSQHCWHVNMBKB-UHFFFAOYSA-N
XLogP1.31
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine?
The IUPAC name of N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine (CID 54383683) is N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine.
What is the SMILES notation for N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine?
The canonical SMILES for N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine is CCCNC1C=c2[nH]c3c(c2CC1)C=CCC=3.
What is the InChIKey of N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine?
The InChIKey is VBSQHCWHVNMBKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-2-9-16-11-7-8-13-12-5-3-4-6-14(12)17-15(13)10-11/h3,5-6,10-11,16-17H,2,4,7-9H2,1H3.
What are the key properties of N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine?
N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine has a molecular weight of 228.34 g/mol, XLogP of 1.31, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3,4,7,9-tetrahydro-2H-carbazol-2-amine is sourced from PubChem (CID 54383683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).