3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine

C16H27N3O — CID 115923056

IUPAC3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine
SMILESCCCN1CCC(Nc2ncccc2OC(C)C)CC1
InChIInChI=1S/C16H27N3O/c1-4-10-19-11-7-14(8-12-19)18-16-15(20-13(2)3)6-5-9-17-16/h5-6,9,13-14H,4,7-8,10-12H2,1-3H3,(H,17,18)
InChIKeyZQEYRYGFLDDQMT-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.16
Rot. Bonds6

About 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine

3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine (PubChem CID 115923056) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine
PubChem CID115923056
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine
SMILESCCCN1CCC(Nc2ncccc2OC(C)C)CC1
InChIInChI=1S/C16H27N3O/c1-4-10-19-11-7-14(8-12-19)18-16-15(20-13(2)3)6-5-9-17-16/h5-6,9,13-14H,4,7-8,10-12H2,1-3H3,(H,17,18)
InChIKeyZQEYRYGFLDDQMT-UHFFFAOYSA-N
XLogP3.16
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methylsulfonyl-N-(1-propylpiperidin-4-yl)pyridin-2-amine
CID 114598779
N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine
CID 133468910
N-(2-methylcyclopentyl)-3-propan-2-yloxypyridin-2-amine
CID 112568510
N-(2-methyl-3-pyridinyl)-1-propylazepan-4-amine
CID 79041986
4-N-(3-ethoxy-2-pyridinyl)cyclohexane-1,4-diamine
CID 113370712
1-ethyl-N-(2-propan-2-yloxy-3-pyridinyl)azepan-4-amine
CID 65073239
N-[2-(chloromethyl)cyclopentyl]-3-propan-2-yloxypyridin-2-amine
CID 106365544
N-[[2-(2-fluorophenoxy)-3-pyridinyl]methyl]-1-propylpiperidin-4-amine
CID 29086962
6-N-methyl-5-propan-2-yl-4-N-(1-propylpiperidin-4-yl)pyrimidine-4,6-diamine
CID 80783092
N-(3-ethoxyphenyl)-1-propylpiperidin-4-amine
CID 54864978
N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine
CID 113370845
5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine
CID 54963421

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine?
The IUPAC name of 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine (CID 115923056) is 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine.
What is the SMILES notation for 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine?
The canonical SMILES for 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine is CCCN1CCC(Nc2ncccc2OC(C)C)CC1.
What is the InChIKey of 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine?
The InChIKey is ZQEYRYGFLDDQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-4-10-19-11-7-14(8-12-19)18-16-15(20-13(2)3)6-5-9-17-16/h5-6,9,13-14H,4,7-8,10-12H2,1-3H3,(H,17,18).
What are the key properties of 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine?
3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine has a molecular weight of 277.41 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine is sourced from PubChem (CID 115923056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).