N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine

C25H28N4 — CID 55767100

IUPACN-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
SMILESCCn1c2ccccc2c2cc(CNC3CCN(c4ccccn4)CC3)ccc21
InChIInChI=1S/C25H28N4/c1-2-29-23-8-4-3-7-21(23)22-17-19(10-11-24(22)29)18-27-20-12-15-28(16-13-20)25-9-5-6-14-26-25/h3-11,14,17,20,27H,2,12-13,15-16,18H2,1H3
InChIKeyBGQLXEVMQXFBRJ-UHFFFAOYSA-N
MW384.53 g/mol
LogP4.97
Rot. Bonds5

About N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine

N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine (PubChem CID 55767100) has the molecular formula C25H28N4 and a molecular weight of 384.53 g/mol. Its IUPAC name is N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
PubChem CID55767100
Molecular FormulaC25H28N4
Molecular Weight384.53 g/mol
Exact Mass384.23
IUPAC NameN-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
SMILESCCn1c2ccccc2c2cc(CNC3CCN(c4ccccn4)CC3)ccc21
InChIInChI=1S/C25H28N4/c1-2-29-23-8-4-3-7-21(23)22-17-19(10-11-24(22)29)18-27-20-12-15-28(16-13-20)25-9-5-6-14-26-25/h3-11,14,17,20,27H,2,12-13,15-16,18H2,1H3
InChIKeyBGQLXEVMQXFBRJ-UHFFFAOYSA-N
XLogP4.97
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.53
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(9-ethylcarbazol-3-yl)methyl]cyclopentanamine;hydrochloride
CID 17331028
N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 119126767
N-[(3-fluorophenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 43675369
N-[(1-methylpyrazol-4-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 43675359
(1S)-N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylethanamine
CID 32664036
N-[(4,5-dibromofuran-2-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 62084118
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 43675430
N-[(2-aminophenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 66387456
N-[(6-bromo-2-pyridinyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 115937851
N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675384
N-(9-ethylcarbazol-3-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 22458846
N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine
CID 43761755

Frequently Asked Questions

What is the IUPAC name of N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine?
The IUPAC name of N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine (CID 55767100) is N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine.
What is the SMILES notation for N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine?
The canonical SMILES for N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine is CCn1c2ccccc2c2cc(CNC3CCN(c4ccccn4)CC3)ccc21.
What is the InChIKey of N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine?
The InChIKey is BGQLXEVMQXFBRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N4/c1-2-29-23-8-4-3-7-21(23)22-17-19(10-11-24(22)29)18-27-20-12-15-28(16-13-20)25-9-5-6-14-26-25/h3-11,14,17,20,27H,2,12-13,15-16,18H2,1H3.
What are the key properties of N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine?
N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine has a molecular weight of 384.53 g/mol, XLogP of 4.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine is sourced from PubChem (CID 55767100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).