2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide

C15H30N4O2 — CID 79704024

IUPAC2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CN(CC1CCNCC1)C(C)C
InChIInChI=1S/C15H30N4O2/c1-4-7-17-15(21)18-14(20)11-19(12(2)3)10-13-5-8-16-9-6-13/h12-13,16H,4-11H2,1-3H3,(H2,17,18,20,21)
InChIKeyKPDDPVUSKFDPNZ-UHFFFAOYSA-N
MW298.43 g/mol
LogP0.93
Rot. Bonds7

About 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide

2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide (PubChem CID 79704024) has the molecular formula C15H30N4O2 and a molecular weight of 298.43 g/mol. Its IUPAC name is 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide
PubChem CID79704024
Molecular FormulaC15H30N4O2
Molecular Weight298.43 g/mol
Exact Mass298.24
IUPAC Name2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CN(CC1CCNCC1)C(C)C
InChIInChI=1S/C15H30N4O2/c1-4-7-17-15(21)18-14(20)11-19(12(2)3)10-13-5-8-16-9-6-13/h12-13,16H,4-11H2,1-3H3,(H2,17,18,20,21)
InChIKeyKPDDPVUSKFDPNZ-UHFFFAOYSA-N
XLogP0.93
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide
CID 79714649
2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide
CID 79716409
N-(ethylcarbamoyl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614699
2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide
CID 106632199
2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylprop-2-en-1-amine
CID 79713998
N-methyl-4-[piperidin-4-ylmethyl(propan-2-yl)amino]butanamide
CID 79714818
2-[cyclopropylmethyl(propan-2-yl)amino]-N-prop-2-ynylacetamide
CID 112731200
2-[(2-piperidin-4-ylacetyl)amino]-N-propylpropanamide
CID 54980022
ethyl N-(piperidin-4-ylmethyl)-N-propan-2-ylcarbamate
CID 79721032
2-[cyclohexyl(methyl)amino]-N-(propylcarbamoyl)acetamide
CID 40706145
N-(2-methylpropylcarbamoyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119932861
2-[cyclopropyl(piperidin-4-ylmethyl)amino]-N-(ethylcarbamoyl)propanamide
CID 79703748

Frequently Asked Questions

What is the IUPAC name of 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide?
The IUPAC name of 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide (CID 79704024) is 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide.
What is the SMILES notation for 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide?
The canonical SMILES for 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide is CCCNC(=O)NC(=O)CN(CC1CCNCC1)C(C)C.
What is the InChIKey of 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide?
The InChIKey is KPDDPVUSKFDPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O2/c1-4-7-17-15(21)18-14(20)11-19(12(2)3)10-13-5-8-16-9-6-13/h12-13,16H,4-11H2,1-3H3,(H2,17,18,20,21).
What are the key properties of 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide?
2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide has a molecular weight of 298.43 g/mol, XLogP of 0.93, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide is sourced from PubChem (CID 79704024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).