N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride

C18H23ClN2 — CID 17156280

IUPACN-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride
SMILESCCn1c2ccccc2c2cc(CNC(C)C)ccc21.Cl
InChIInChI=1S/C18H22N2.ClH/c1-4-20-17-8-6-5-7-15(17)16-11-14(9-10-18(16)20)12-19-13(2)3;/h5-11,13,19H,4,12H2,1-3H3;1H
InChIKeyYUDYLMPQFDQGIK-UHFFFAOYSA-N
MW302.85 g/mol
LogP4.73
Rot. Bonds4

About N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride

N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride (PubChem CID 17156280) has the molecular formula C18H23ClN2 and a molecular weight of 302.85 g/mol. Its IUPAC name is N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride.

Molecular Properties

Compound NameN-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride
PubChem CID17156280
Molecular FormulaC18H23ClN2
Molecular Weight302.85 g/mol
Exact Mass302.15
IUPAC NameN-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride
SMILESCCn1c2ccccc2c2cc(CNC(C)C)ccc21.Cl
InChIInChI=1S/C18H22N2.ClH/c1-4-20-17-8-6-5-7-15(17)16-11-14(9-10-18(16)20)12-19-13(2)3;/h5-11,13,19H,4,12H2,1-3H3;1H
InChIKeyYUDYLMPQFDQGIK-UHFFFAOYSA-N
XLogP4.73
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.85
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[(9-ethylcarbazol-3-yl)methylamino]butan-1-ol
CID 7425045
N-[(9-ethylcarbazol-3-yl)methyl]-1-naphthalen-1-ylethanamine
CID 21087531
2-[(9-ethylcarbazol-3-yl)methylamino]-3-methylbutanoic acid
CID 66527507
(2S)-2-[(9-ethylcarbazol-3-yl)methylamino]-3-methylbutanoic acid
CID 99124071
(1S)-N-[[9-ethyl-6-[[[(1S)-1-phenylethyl]amino]methyl]carbazol-3-yl]methyl]-1-phenylethanamine
CID 25214114
(1S)-N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylethanamine
CID 32664036
N-[(9-ethylcarbazol-3-yl)methyl]-2-methylpropanamide
CID 70245099
N-[(9-ethylcarbazol-3-yl)methyl]-1-(4-methylphenyl)methanamine;hydrochloride
CID 17332553
N-[(9-ethylcarbazol-3-yl)methyl]cyclopentanamine;hydrochloride
CID 17331028
1-(9-ethylcarbazol-3-yl)propan-2-ol
CID 117386647
N-[(9-ethylcarbazol-3-yl)methyl]-1-naphthalen-2-ylmethanamine
CID 164792573
2-[(9-ethylcarbazol-3-yl)methyl]-1,1-diphenylhydrazine
CID 59931550

Frequently Asked Questions

What is the IUPAC name of N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride?
The IUPAC name of N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride (CID 17156280) is N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride.
What is the SMILES notation for N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride?
The canonical SMILES for N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride is CCn1c2ccccc2c2cc(CNC(C)C)ccc21.Cl.
What is the InChIKey of N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride?
The InChIKey is YUDYLMPQFDQGIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2.ClH/c1-4-20-17-8-6-5-7-15(17)16-11-14(9-10-18(16)20)12-19-13(2)3;/h5-11,13,19H,4,12H2,1-3H3;1H.
What are the key properties of N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride?
N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride has a molecular weight of 302.85 g/mol, XLogP of 4.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(9-ethylcarbazol-3-yl)methyl]propan-2-amine;hydrochloride is sourced from PubChem (CID 17156280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).