N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine

C15H20N2 — CID 11219296

IUPACN-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
SMILESCCCNC1CCCc2c1[nH]c1ccccc21
InChIInChI=1S/C15H20N2/c1-2-10-16-14-9-5-7-12-11-6-3-4-8-13(11)17-15(12)14/h3-4,6,8,14,16-17H,2,5,7,9-10H2,1H3
InChIKeyYAAWECHWTLGVTJ-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.54
Rot. Bonds3

About N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine

N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine (PubChem CID 11219296) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine.

Molecular Properties

Compound NameN-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
PubChem CID11219296
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC NameN-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
SMILESCCCNC1CCCc2c1[nH]c1ccccc21
InChIInChI=1S/C15H20N2/c1-2-10-16-14-9-5-7-12-11-6-3-4-8-13(11)17-15(12)14/h3-4,6,8,14,16-17H,2,5,7,9-10H2,1H3
InChIKeyYAAWECHWTLGVTJ-UHFFFAOYSA-N
XLogP3.54
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 ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

N',N'-diethyl-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)ethane-1,2-diamine
CID 65333850
N',N'-dimethyl-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)ethane-1,2-diamine
CID 65334146
N'-ethyl-N'-methyl-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)ethane-1,2-diamine
CID 65334005
N',N'-dimethyl-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)propane-1,3-diamine
CID 65334049
N-(4-methylpentyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65333957
N-(2,2-dimethylpropyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65334003
6-chloro-N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65332691
N-[2-(4-cyclopropylphenyl)ethyl]-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 176892760
8-fluoro-N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65333139
2-[1-[(2,3,4,9-tetrahydro-1H-carbazol-1-ylamino)methyl]cyclopropyl]ethanol
CID 114756055
methyl 2-(2,3,4,9-tetrahydro-1H-carbazol-1-ylamino)acetate
CID 65333695
N-[(2-methylcyclopentyl)methyl]-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 107416848

Frequently Asked Questions

What is the IUPAC name of N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine?
The IUPAC name of N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine (CID 11219296) is N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine.
What is the SMILES notation for N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine?
The canonical SMILES for N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine is CCCNC1CCCc2c1[nH]c1ccccc21.
What is the InChIKey of N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine?
The InChIKey is YAAWECHWTLGVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-2-10-16-14-9-5-7-12-11-6-3-4-8-13(11)17-15(12)14/h3-4,6,8,14,16-17H,2,5,7,9-10H2,1H3.
What are the key properties of N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine?
N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine has a molecular weight of 228.34 g/mol, XLogP of 3.54, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine is sourced from PubChem (CID 11219296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).