N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine

C17H29N3 — CID 62289463

IUPACN-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine
SMILESCCCCN(c1ccc(CNC2CC2)cn1)C(C)CC
InChIInChI=1S/C17H29N3/c1-4-6-11-20(14(3)5-2)17-10-7-15(13-19-17)12-18-16-8-9-16/h7,10,13-14,16,18H,4-6,8-9,11-12H2,1-3H3
InChIKeyWILXXOILRNYKAW-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.74
Rot. Bonds9

About N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine

N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine (PubChem CID 62289463) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine
PubChem CID62289463
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC NameN-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine
SMILESCCCCN(c1ccc(CNC2CC2)cn1)C(C)CC
InChIInChI=1S/C17H29N3/c1-4-6-11-20(14(3)5-2)17-10-7-15(13-19-17)12-18-16-8-9-16/h7,10,13-14,16,18H,4-6,8-9,11-12H2,1-3H3
InChIKeyWILXXOILRNYKAW-UHFFFAOYSA-N
XLogP3.74
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-5-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
CID 62278694
5-(aminomethyl)-N-butan-2-yl-N-butylpyridin-2-amine
CID 55000369
N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]-3-methylpyridin-2-amine
CID 80632919
N-butan-2-yl-N-butyl-5-[(2-methoxyethylamino)methyl]pyridin-2-amine
CID 80632466
5-[(cyclopropylamino)methyl]-N-methyl-N-(2-methylbutyl)pyridin-2-amine
CID 62280084
5-[(cyclopropylamino)methyl]-N-(3-methoxypropyl)-N-methylpyridin-2-amine
CID 63008122
5-[(cyclopropylamino)methyl]-N-methyl-N-(2-methylsulfanylethyl)pyridin-2-amine
CID 112662259
5-[(cyclopropylamino)methyl]-N-(cyclopropylmethyl)-N-ethylpyridin-2-amine
CID 63940452
5-[(cyclopropylamino)methyl]-N-methyl-N-phenylpyridin-2-amine
CID 62285256
N-cyclopentyl-5-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
CID 62281128
N-[(4-bromophenyl)methyl]-5-[(cyclopropylamino)methyl]-N-methylpyridin-2-amine
CID 62287672
6-[(cyclopropylamino)methyl]-N-pentyl-N-propan-2-ylpyridazin-3-amine
CID 62294875

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine?
The IUPAC name of N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine (CID 62289463) is N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine?
The canonical SMILES for N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine is CCCCN(c1ccc(CNC2CC2)cn1)C(C)CC.
What is the InChIKey of N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine?
The InChIKey is WILXXOILRNYKAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-4-6-11-20(14(3)5-2)17-10-7-15(13-19-17)12-18-16-8-9-16/h7,10,13-14,16,18H,4-6,8-9,11-12H2,1-3H3.
What are the key properties of N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine?
N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine has a molecular weight of 275.44 g/mol, XLogP of 3.74, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 62289463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).