N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine

C12H21N3 — CID 105072693

IUPACN-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine
SMILESCCCCN(C)c1cnccc1CNC
InChIInChI=1S/C12H21N3/c1-4-5-8-15(3)12-10-14-7-6-11(12)9-13-2/h6-7,10,13H,4-5,8-9H2,1-3H3
InChIKeyMJWQXNIRCUWDMV-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.04
Rot. Bonds6

About N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine

N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine (PubChem CID 105072693) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine.

Molecular Properties

Compound NameN-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine
PubChem CID105072693
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC NameN-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine
SMILESCCCCN(C)c1cnccc1CNC
InChIInChI=1S/C12H21N3/c1-4-5-8-15(3)12-10-14-7-6-11(12)9-13-2/h6-7,10,13H,4-5,8-9H2,1-3H3
InChIKeyMJWQXNIRCUWDMV-UHFFFAOYSA-N
XLogP2.04
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(methylaminomethyl)-N-(2-pyridin-4-ylethyl)pyridin-3-amine
CID 105073101
N-methyl-4-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine
CID 105072723
N-butyl-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine
CID 81249829
3-N-butyl-3-N-methylpyridine-3,4-diamine;methanamine
CID 143837442
N'-[4-[(tert-butylamino)methyl]-3-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 105073949
N,N-dibutyl-4-[(propan-2-ylamino)methyl]pyridin-3-amine
CID 105072837
N-methyl-4-(methylaminomethyl)-N-(1-methylsulfanylpropan-2-yl)pyridin-3-amine
CID 105074392
N,N-dibutyl-4-[(tert-butylamino)methyl]pyridin-3-amine
CID 105072835
N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine
CID 81246740
N-(furan-3-ylmethyl)-N-methyl-4-(methylaminomethyl)pyridin-3-amine
CID 105073490
N-ethyl-4-(methylaminomethyl)-N-(pyridin-4-ylmethyl)pyridin-3-amine
CID 105073292
N-butyl-4-[(tert-butylamino)methyl]-N-ethylpyridin-3-amine
CID 105072707

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine?
The IUPAC name of N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine (CID 105072693) is N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine.
What is the SMILES notation for N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine?
The canonical SMILES for N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine is CCCCN(C)c1cnccc1CNC.
What is the InChIKey of N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine?
The InChIKey is MJWQXNIRCUWDMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-4-5-8-15(3)12-10-14-7-6-11(12)9-13-2/h6-7,10,13H,4-5,8-9H2,1-3H3.
What are the key properties of N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine?
N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine has a molecular weight of 207.32 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine is sourced from PubChem (CID 105072693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).