(1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine

C19H25N3 — CID 171213041

IUPAC(1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine
SMILESCCn1c2ccccc2c2cc([C@H](N)CCCCN)ccc21
InChIInChI=1S/C19H25N3/c1-2-22-18-9-4-3-7-15(18)16-13-14(10-11-19(16)22)17(21)8-5-6-12-20/h3-4,7,9-11,13,17H,2,5-6,8,12,20-21H2,1H3/t17-/m1/s1
InChIKeyWKIDXVSJDNJHNU-QGZVFWFLSA-N
MW295.43 g/mol
LogP3.94
Rot. Bonds6

About (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine

(1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine (PubChem CID 171213041) has the molecular formula C19H25N3 and a molecular weight of 295.43 g/mol. Its IUPAC name is (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine.

Molecular Properties

Compound Name(1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine
PubChem CID171213041
Molecular FormulaC19H25N3
Molecular Weight295.43 g/mol
Exact Mass295.20
IUPAC Name(1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine
SMILESCCn1c2ccccc2c2cc([C@H](N)CCCCN)ccc21
InChIInChI=1S/C19H25N3/c1-2-22-18-9-4-3-7-15(18)16-13-14(10-11-19(16)22)17(21)8-5-6-12-20/h3-4,7,9-11,13,17H,2,5-6,8,12,20-21H2,1H3/t17-/m1/s1
InChIKeyWKIDXVSJDNJHNU-QGZVFWFLSA-N
XLogP3.94
TPSA56.97 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(1S)-1-(9-ethylcarbazol-3-yl)butane-1,4-diamine
CID 171232656
(1R)-1-(9-ethylcarbazol-3-yl)-2-fluoroethanamine;hydrochloride
CID 171232651
(3S)-3-amino-3-(9-ethylcarbazol-3-yl)propanenitrile
CID 171260153
(R)-cyclopropyl-(9-ethylcarbazol-3-yl)methanamine
CID 171213067
3-amino-1-(9-ethylcarbazol-3-yl)propane-1,2-diol
CID 170829191
3-butan-2-yl-9-ethylcarbazole
CID 23520664
(R)-cyclopentyl-(9-ethylcarbazol-3-yl)methanamine
CID 171213069
9-ethyl-3-[(9-ethylcarbazol-3-yl)-(4-phenylphenyl)methyl]carbazole
CID 14093933
(1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride
CID 171264882
2-(9-ethylcarbazol-3-yl)-2-hydroxyacetic acid
CID 117426376
1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol
CID 170819012
(R)-(9-ethylcarbazol-3-yl)-(oxan-4-yl)methanamine
CID 171250725

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine?
The IUPAC name of (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine (CID 171213041) is (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine.
What is the SMILES notation for (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine?
The canonical SMILES for (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine is CCn1c2ccccc2c2cc([C@H](N)CCCCN)ccc21.
What is the InChIKey of (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine?
The InChIKey is WKIDXVSJDNJHNU-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H25N3/c1-2-22-18-9-4-3-7-15(18)16-13-14(10-11-19(16)22)17(21)8-5-6-12-20/h3-4,7,9-11,13,17H,2,5-6,8,12,20-21H2,1H3/t17-/m1/s1.
What are the key properties of (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine?
(1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine has a molecular weight of 295.43 g/mol, XLogP of 3.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine is sourced from PubChem (CID 171213041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).