N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine

C14H19N3 — CID 151286436

IUPACN-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine
SMILESCC1CCC(Nc2ccnc3c[nH]cc23)CC1
InChIInChI=1S/C14H19N3/c1-10-2-4-11(5-3-10)17-13-6-7-16-14-9-15-8-12(13)14/h6-11,15,17H,2-5H2,1H3
InChIKeyDAKUUJFKOMPILB-UHFFFAOYSA-N
MW229.33 g/mol
LogP3.55
Rot. Bonds2

About N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine

N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine (PubChem CID 151286436) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine
PubChem CID151286436
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC NameN-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine
SMILESCC1CCC(Nc2ccnc3c[nH]cc23)CC1
InChIInChI=1S/C14H19N3/c1-10-2-4-11(5-3-10)17-13-6-7-16-14-9-15-8-12(13)14/h6-11,15,17H,2-5H2,1H3
InChIKeyDAKUUJFKOMPILB-UHFFFAOYSA-N
XLogP3.55
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylcyclopentyl)quinolin-5-amine
CID 64501004
cis-(1R,3S)-3-(quinolin-4-ylamino)cyclopentane-1-carboxylic acid
CID 106322010
N-(1-oxothian-4-yl)quinolin-4-amine
CID 113480106
4-[(4-methylcyclohexyl)amino]pyridine-2-carboxylic acid
CID 43143066
2-methyl-N-(4-methylcyclohexyl)pyrazol-3-amine
CID 115702879
1-N-(6-bromoquinolin-4-yl)-4-N,4-N-diethylcyclohexane-1,4-diamine
CID 173470241
N-(4-methylcyclohexyl)pyrido[2,3-b]pyrazin-6-amine
CID 78981139
7-chloro-N-(1-propylpiperidin-4-yl)quinolin-4-amine
CID 60667072
6-fluoro-N-piperidin-4-ylquinolin-4-amine
CID 68720863
3-[(4-methylcycloheptyl)amino]pyridine-4-carbonitrile
CID 102809585
4-N-(7-chloroquinolin-4-yl)-1-N-(2-methylpropyl)cyclohexane-1,4-diamine
CID 69198675
7-chloro-N-(3-methylsulfanylcyclopentyl)quinolin-4-amine
CID 103704139

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine?
The IUPAC name of N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine (CID 151286436) is N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine.
What is the SMILES notation for N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine?
The canonical SMILES for N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine is CC1CCC(Nc2ccnc3c[nH]cc23)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine?
The InChIKey is DAKUUJFKOMPILB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-10-2-4-11(5-3-10)17-13-6-7-16-14-9-15-8-12(13)14/h6-11,15,17H,2-5H2,1H3.
What are the key properties of N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine?
N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine has a molecular weight of 229.33 g/mol, XLogP of 3.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-6H-pyrrolo[3,4-b]pyridin-4-amine is sourced from PubChem (CID 151286436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).