N-methyl-1-pyridin-3-ylbutan-2-amine

C10H16N2 — CID 62552734

IUPACN-methyl-1-pyridin-3-ylbutan-2-amine
SMILESCCC(Cc1cccnc1)NC
InChIInChI=1S/C10H16N2/c1-3-10(11-2)7-9-5-4-6-12-8-9/h4-6,8,10-11H,3,7H2,1-2H3
InChIKeyLFUYNBHNDQLKCU-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.62
Rot. Bonds4

About N-methyl-1-pyridin-3-ylbutan-2-amine

N-methyl-1-pyridin-3-ylbutan-2-amine (PubChem CID 62552734) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is N-methyl-1-pyridin-3-ylbutan-2-amine.

Molecular Properties

Compound NameN-methyl-1-pyridin-3-ylbutan-2-amine
PubChem CID62552734
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC NameN-methyl-1-pyridin-3-ylbutan-2-amine
SMILESCCC(Cc1cccnc1)NC
InChIInChI=1S/C10H16N2/c1-3-10(11-2)7-9-5-4-6-12-8-9/h4-6,8,10-11H,3,7H2,1-2H3
InChIKeyLFUYNBHNDQLKCU-UHFFFAOYSA-N
XLogP1.62
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,4-dimethyl-1-pyridin-3-ylheptan-2-amine
CID 62604003
N-methyl-1-pyridin-3-yldodecan-2-amine
CID 63416247
1-(3,5-dimethylphenyl)-N-methyl-3-pyridin-3-ylpropan-2-amine
CID 62552074
N,4-dimethyl-1-pyridin-3-ylpent-4-en-2-amine
CID 79180331
4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine
CID 115601894
N-methyl-5-phenyl-1-pyridin-3-ylpentan-2-amine
CID 62604554
1-(3-bromophenyl)-N-methyl-3-pyridin-3-ylpropan-2-amine
CID 62550846
N-methyl-4-methylsulfonyl-1-pyridin-3-ylbutan-2-amine
CID 62604364
1-cyclohexyl-N-methyl-3-pyridin-3-ylpropan-2-amine
CID 62603236
(2S)-1-pyridin-3-ylbutan-2-amine
CID 93246137
1,1-difluoro-N-methyl-3-pyridin-3-ylpropan-2-amine
CID 103759818
N-methyl-4-(1-methylpyrazol-4-yl)-1-pyridin-3-ylbutan-2-amine
CID 103009789

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-pyridin-3-ylbutan-2-amine?
The IUPAC name of N-methyl-1-pyridin-3-ylbutan-2-amine (CID 62552734) is N-methyl-1-pyridin-3-ylbutan-2-amine.
What is the SMILES notation for N-methyl-1-pyridin-3-ylbutan-2-amine?
The canonical SMILES for N-methyl-1-pyridin-3-ylbutan-2-amine is CCC(Cc1cccnc1)NC.
What is the InChIKey of N-methyl-1-pyridin-3-ylbutan-2-amine?
The InChIKey is LFUYNBHNDQLKCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-3-10(11-2)7-9-5-4-6-12-8-9/h4-6,8,10-11H,3,7H2,1-2H3.
What are the key properties of N-methyl-1-pyridin-3-ylbutan-2-amine?
N-methyl-1-pyridin-3-ylbutan-2-amine has a molecular weight of 164.25 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyridin-3-ylbutan-2-amine is sourced from PubChem (CID 62552734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).