N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine

C16H29N3 — CID 62284127

IUPACN-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine
SMILESCC(C)CNCc1cc(N(C)C(C)C(C)C)ccn1
InChIInChI=1S/C16H29N3/c1-12(2)10-17-11-15-9-16(7-8-18-15)19(6)14(5)13(3)4/h7-9,12-14,17H,10-11H2,1-6H3
InChIKeyZCWGEMLRHUAOJI-UHFFFAOYSA-N
MW263.43 g/mol
LogP3.31
Rot. Bonds7

About N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine

N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine (PubChem CID 62284127) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine
PubChem CID62284127
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC NameN-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine
SMILESCC(C)CNCc1cc(N(C)C(C)C(C)C)ccn1
InChIInChI=1S/C16H29N3/c1-12(2)10-17-11-15-9-16(7-8-18-15)19(6)14(5)13(3)4/h7-9,12-14,17H,10-11H2,1-6H3
InChIKeyZCWGEMLRHUAOJI-UHFFFAOYSA-N
XLogP3.31
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[(2-methylpropylamino)methyl]-N-phenylpyridin-4-amine
CID 62284741
N-(2,2-dimethylpropyl)-N-methyl-2-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 62289015
N-methyl-N-(2-methylcyclohexyl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 62287919
N-(2-ethoxyethyl)-N-methyl-2-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 81074807
2-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-4-amine
CID 62283982
N-(cyclopropylmethyl)-N-ethyl-2-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 63940070
2-[(tert-butylamino)methyl]-N-(3,3-dimethylbutan-2-yl)-N-methylpyridin-4-amine
CID 62283361
N-(2-methoxyethyl)-2-[(2-methylpropylamino)methyl]-N-prop-2-enylpyridin-4-amine
CID 103340187
2-(ethylaminomethyl)-N,N-bis(2-methylpropyl)pyridin-4-amine
CID 62284205
2-(ethylaminomethyl)-N-methyl-N-(1-thiophen-2-ylethyl)pyridin-4-amine
CID 55059591
N-[(4-butan-2-yloxy-2-pyridinyl)methyl]-2-methylpropan-1-amine
CID 62296126
2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine;hydrochloride
CID 17332283

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine?
The IUPAC name of N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine (CID 62284127) is N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine.
What is the SMILES notation for N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine?
The canonical SMILES for N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine is CC(C)CNCc1cc(N(C)C(C)C(C)C)ccn1.
What is the InChIKey of N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine?
The InChIKey is ZCWGEMLRHUAOJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-12(2)10-17-11-15-9-16(7-8-18-15)19(6)14(5)13(3)4/h7-9,12-14,17H,10-11H2,1-6H3.
What are the key properties of N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine?
N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine has a molecular weight of 263.43 g/mol, XLogP of 3.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylbutan-2-yl)-2-[(2-methylpropylamino)methyl]pyridin-4-amine is sourced from PubChem (CID 62284127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).