N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine

C14H23N3 — CID 43689479

IUPACN-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine
SMILESCCC(C)CNc1ccc(N2CCCC2)nc1
InChIInChI=1S/C14H23N3/c1-3-12(2)10-15-13-6-7-14(16-11-13)17-8-4-5-9-17/h6-7,11-12,15H,3-5,8-10H2,1-2H3
InChIKeyMSUFLOWWSZVMHT-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.14
Rot. Bonds5

About N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine

N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine (PubChem CID 43689479) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine
PubChem CID43689479
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine
SMILESCCC(C)CNc1ccc(N2CCCC2)nc1
InChIInChI=1S/C14H23N3/c1-3-12(2)10-15-13-6-7-14(16-11-13)17-8-4-5-9-17/h6-7,11-12,15H,3-5,8-10H2,1-2H3
InChIKeyMSUFLOWWSZVMHT-UHFFFAOYSA-N
XLogP3.14
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689606
2-propan-2-yl-N'-(6-pyrrolidin-1-yl-3-pyridinyl)propane-1,3-diamine
CID 107441523
N-(2-methylbutyl)-4-pyrrolidin-1-ylaniline
CID 43732150
N-pentan-2-yl-6-piperidin-1-ylpyridin-3-amine
CID 43690334
N-(1-ethoxypropan-2-yl)-6-pyrrolidin-1-ylpyridin-3-amine
CID 115922081
N-(1-cyclopropylpropyl)-6-piperidin-1-ylpyridin-3-amine
CID 64917341
N-(3-methoxy-2-methylpropyl)-6-morpholin-4-ylpyridin-3-amine
CID 116501035
(6-piperidin-1-yl-3-pyridinyl)hydrazine
CID 55281305
N-(1-cyclobutylpropan-2-yl)-6-pyrrolidin-1-ylpyridin-3-amine
CID 115922079
2-amino-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 43704585
N-(cyclopropylmethyl)-6-piperidin-1-ylpyridin-3-amine
CID 43690356
N-[[6-(azocan-1-yl)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62279303

Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine?
The IUPAC name of N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine (CID 43689479) is N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine.
What is the SMILES notation for N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine?
The canonical SMILES for N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine is CCC(C)CNc1ccc(N2CCCC2)nc1.
What is the InChIKey of N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine?
The InChIKey is MSUFLOWWSZVMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-12(2)10-15-13-6-7-14(16-11-13)17-8-4-5-9-17/h6-7,11-12,15H,3-5,8-10H2,1-2H3.
What are the key properties of N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine?
N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine has a molecular weight of 233.36 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine is sourced from PubChem (CID 43689479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).