N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine

C17H31N3 — CID 62279387

IUPACN,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCc1cc(C)c(CNCC(C)C)c(N(C)CC(C)C)n1
InChIInChI=1S/C17H31N3/c1-12(2)9-18-10-16-14(5)8-15(6)19-17(16)20(7)11-13(3)4/h8,12-13,18H,9-11H2,1-7H3
InChIKeyWCQIRJMNNTVTNM-UHFFFAOYSA-N
MW277.46 g/mol
LogP3.54
Rot. Bonds7

About N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine

N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine (PubChem CID 62279387) has the molecular formula C17H31N3 and a molecular weight of 277.46 g/mol. Its IUPAC name is N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine
PubChem CID62279387
Molecular FormulaC17H31N3
Molecular Weight277.46 g/mol
Exact Mass277.25
IUPAC NameN,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCc1cc(C)c(CNCC(C)C)c(N(C)CC(C)C)n1
InChIInChI=1S/C17H31N3/c1-12(2)9-18-10-16-14(5)8-15(6)19-17(16)20(7)11-13(3)4/h8,12-13,18H,9-11H2,1-7H3
InChIKeyWCQIRJMNNTVTNM-UHFFFAOYSA-N
XLogP3.54
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.46
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethylaminomethyl)-N,4,6-trimethyl-N-(2-methylpropyl)pyridin-2-amine
CID 62279212
N,4,6-trimethyl-3-[(2-methylpropylamino)methyl]-N-pentan-3-ylpyridin-2-amine
CID 63487572
N-cyclopropyl-N-ethyl-4,6-dimethyl-3-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62279375
N-ethyl-3-(ethylaminomethyl)-4,6-dimethyl-N-(2-methylpropyl)pyridin-2-amine
CID 62280772
N-ethyl-N-(2-methoxyethyl)-4,6-dimethyl-3-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62293749
N-(cyclopropylmethyl)-N-ethyl-4,6-dimethyl-3-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 63941047
N-butan-2-yl-3-(ethylaminomethyl)-N,4,6-trimethylpyridin-2-amine
CID 62280727
N-[[2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethyl-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62294700
N-[(4,6-dimethyl-2-prop-2-enoxy-3-pyridinyl)methyl]-2-methylpropan-1-amine
CID 62288248
N-(2-methoxypropyl)-4,6-dimethyl-3-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 102700817
N'-[4,6-dimethyl-3-[(propan-2-ylamino)methyl]-2-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63700898
3-(aminomethyl)-4,6-dimethyl-N,N-bis(2-methylpropyl)pyridin-2-amine
CID 61176128

Frequently Asked Questions

What is the IUPAC name of N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine?
The IUPAC name of N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine (CID 62279387) is N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine?
The canonical SMILES for N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine is Cc1cc(C)c(CNCC(C)C)c(N(C)CC(C)C)n1.
What is the InChIKey of N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine?
The InChIKey is WCQIRJMNNTVTNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3/c1-12(2)9-18-10-16-14(5)8-15(6)19-17(16)20(7)11-13(3)4/h8,12-13,18H,9-11H2,1-7H3.
What are the key properties of N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine?
N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine has a molecular weight of 277.46 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,6-trimethyl-N-(2-methylpropyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 62279387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).