N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine

C16H29N3O — CID 106387838

IUPACN-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine
SMILESCCCN1CCCC(C(C)NC(C)c2ncc(C)o2)C1
InChIInChI=1S/C16H29N3O/c1-5-8-19-9-6-7-15(11-19)13(3)18-14(4)16-17-10-12(2)20-16/h10,13-15,18H,5-9,11H2,1-4H3
InChIKeyVARWFKCLVWVXTA-UHFFFAOYSA-N
MW279.43 g/mol
LogP3.14
Rot. Bonds6

About N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine

N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine (PubChem CID 106387838) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine.

Molecular Properties

Compound NameN-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine
PubChem CID106387838
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC NameN-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine
SMILESCCCN1CCCC(C(C)NC(C)c2ncc(C)o2)C1
InChIInChI=1S/C16H29N3O/c1-5-8-19-9-6-7-15(11-19)13(3)18-14(4)16-17-10-12(2)20-16/h10,13-15,18H,5-9,11H2,1-4H3
InChIKeyVARWFKCLVWVXTA-UHFFFAOYSA-N
XLogP3.14
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-N-propylpiperidin-3-amine
CID 114182566
3-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]butan-2-amine
CID 43308725
N-[(1S)-1-(2-chlorophenyl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine
CID 81375624
N-[1-(2-fluorophenyl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine
CID 60928302
N-[(1S)-1-(3-bromophenyl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine
CID 81381973
1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-N-propan-2-ylpiperidin-3-amine
CID 103895042
1-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyrazol-4-amine
CID 43534727
1-(1-propylpiperidin-3-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 63829149
1-phenyl-N-[1-(1-propylpiperidin-3-yl)ethyl]propan-2-amine
CID 63011582
4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine
CID 63329410
N-[1-(1-propylpiperidin-3-yl)ethyl]-1,3-thiazol-2-amine
CID 79046499
2,3-dimethyl-N-[1-(1-propylpiperidin-3-yl)ethyl]aniline
CID 43308056

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine?
The IUPAC name of N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine (CID 106387838) is N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine.
What is the SMILES notation for N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine?
The canonical SMILES for N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine is CCCN1CCCC(C(C)NC(C)c2ncc(C)o2)C1.
What is the InChIKey of N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine?
The InChIKey is VARWFKCLVWVXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-5-8-19-9-6-7-15(11-19)13(3)18-14(4)16-17-10-12(2)20-16/h10,13-15,18H,5-9,11H2,1-4H3.
What are the key properties of N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine?
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine has a molecular weight of 279.43 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine is sourced from PubChem (CID 106387838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).