3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine

C16H29N3 — CID 62285279

IUPAC3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine
SMILESCCCN(CCC)c1ncccc1CNCC(C)C
InChIInChI=1S/C16H29N3/c1-5-10-19(11-6-2)16-15(8-7-9-18-16)13-17-12-14(3)4/h7-9,14,17H,5-6,10-13H2,1-4H3
InChIKeyJFBRCEROOPQQSG-UHFFFAOYSA-N
MW263.43 g/mol
LogP3.45
Rot. Bonds9

About 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine

3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine (PubChem CID 62285279) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine.

Molecular Properties

Compound Name3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine
PubChem CID62285279
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC Name3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine
SMILESCCCN(CCC)c1ncccc1CNCC(C)C
InChIInChI=1S/C16H29N3/c1-5-10-19(11-6-2)16-15(8-7-9-18-16)13-17-12-14(3)4/h7-9,14,17H,5-6,10-13H2,1-4H3
InChIKeyJFBRCEROOPQQSG-UHFFFAOYSA-N
XLogP3.45
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-N-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62281070
3-(ethylaminomethyl)-N,N-bis(3-methylbutyl)pyridin-2-amine
CID 107871204
N,N-bis(2-methylpropyl)-3-(propylaminomethyl)pyridin-2-amine
CID 62283165
1-[methyl-[3-[(2-methylpropylamino)methyl]-2-pyridinyl]amino]propan-2-ol
CID 114056940
N-methyl-N-(4-methylphenyl)-3-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62282701
N'-[3-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 62282134
N,N-dibutyl-3-(methylaminomethyl)pyridin-2-amine
CID 62279311
N-(3-fluorophenyl)-N-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62294691
N-(cyclohexylmethyl)-N-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62287115
2-methyl-N-[(2-octoxy-3-pyridinyl)methyl]propan-1-amine
CID 63488126
3-[(2-methylpropylamino)methyl]pyridine-2-carbonitrile
CID 62895521
2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-1-amine
CID 62290330

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine?
The IUPAC name of 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine (CID 62285279) is 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine.
What is the SMILES notation for 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine?
The canonical SMILES for 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine is CCCN(CCC)c1ncccc1CNCC(C)C.
What is the InChIKey of 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine?
The InChIKey is JFBRCEROOPQQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-5-10-19(11-6-2)16-15(8-7-9-18-16)13-17-12-14(3)4/h7-9,14,17H,5-6,10-13H2,1-4H3.
What are the key properties of 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine?
3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine has a molecular weight of 263.43 g/mol, XLogP of 3.45, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methylpropylamino)methyl]-N,N-dipropylpyridin-2-amine is sourced from PubChem (CID 62285279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).