2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide

C14H28N2O2 — CID 119462657

IUPAC2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide
SMILESCC(C)CCOC(C)C(=O)NCC1CCCNC1
InChIInChI=1S/C14H28N2O2/c1-11(2)6-8-18-12(3)14(17)16-10-13-5-4-7-15-9-13/h11-13,15H,4-10H2,1-3H3,(H,16,17)
InChIKeyWMPWTQIYHOWCOF-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.55
Rot. Bonds7

About 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide

2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide (PubChem CID 119462657) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide
PubChem CID119462657
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide
SMILESCC(C)CCOC(C)C(=O)NCC1CCCNC1
InChIInChI=1S/C14H28N2O2/c1-11(2)6-8-18-12(3)14(17)16-10-13-5-4-7-15-9-13/h11-13,15H,4-10H2,1-3H3,(H,16,17)
InChIKeyWMPWTQIYHOWCOF-UHFFFAOYSA-N
XLogP1.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 119461546
N-(2-methoxyethyl)-2-(2-piperidin-3-ylethoxy)propanamide
CID 62357348
2-(oxolan-2-ylmethoxy)-N-(piperidin-3-ylmethyl)propanamide
CID 119462659
2-amino-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 131134455
3-(4-methylpentan-2-yloxy)-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 119464085
1-(piperidin-3-ylmethyl)-3-propan-2-ylurea
CID 43208690
N-cyclopentyl-2-(2-piperidin-3-ylethoxy)propanamide
CID 62357689
2-ethyl-N-(piperidin-3-ylmethyl)butanamide;hydrochloride
CID 119462909
2-methoxy-N-(piperidin-3-ylmethyl)butanamide
CID 119461438
3-methyl-2-(3-methylbutanoylamino)-N-(piperidin-3-ylmethyl)butanamide
CID 119464375
butyl N-(piperidin-3-ylmethyl)carbamate
CID 154053920
2-(cyclopentylmethyl)-N-(piperidin-3-ylmethyl)butanamide
CID 119460240

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide?
The IUPAC name of 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide (CID 119462657) is 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide.
What is the SMILES notation for 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide?
The canonical SMILES for 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide is CC(C)CCOC(C)C(=O)NCC1CCCNC1.
What is the InChIKey of 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide?
The InChIKey is WMPWTQIYHOWCOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-11(2)6-8-18-12(3)14(17)16-10-13-5-4-7-15-9-13/h11-13,15H,4-10H2,1-3H3,(H,16,17).
What are the key properties of 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide?
2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide has a molecular weight of 256.39 g/mol, XLogP of 1.55, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylbutoxy)-N-(piperidin-3-ylmethyl)propanamide is sourced from PubChem (CID 119462657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).