2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide

C15H31N3O2 — CID 106635112

IUPAC2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide
SMILESCC(C)OCCCNC(=O)CN(C)CC1CCCCN1
InChIInChI=1S/C15H31N3O2/c1-13(2)20-10-6-9-17-15(19)12-18(3)11-14-7-4-5-8-16-14/h13-14,16H,4-12H2,1-3H3,(H,17,19)
InChIKeyXVPWHVMYDXPGDK-UHFFFAOYSA-N
MW285.43 g/mol
LogP0.99
Rot. Bonds9

About 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide

2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide (PubChem CID 106635112) has the molecular formula C15H31N3O2 and a molecular weight of 285.43 g/mol. Its IUPAC name is 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide.

Molecular Properties

Compound Name2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide
PubChem CID106635112
Molecular FormulaC15H31N3O2
Molecular Weight285.43 g/mol
Exact Mass285.24
IUPAC Name2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide
SMILESCC(C)OCCCNC(=O)CN(C)CC1CCCCN1
InChIInChI=1S/C15H31N3O2/c1-13(2)20-10-6-9-17-15(19)12-18(3)11-14-7-4-5-8-16-14/h13-14,16H,4-12H2,1-3H3,(H,17,19)
InChIKeyXVPWHVMYDXPGDK-UHFFFAOYSA-N
XLogP0.99
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-propan-2-yloxypropyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119677888
2-[methyl-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]amino]acetic acid
CID 43442393
2-[2-hydroxypropyl(methyl)amino]-N-(3-propan-2-yloxypropyl)acetamide
CID 55061227
2-[(2-hydroxycyclohexyl)-methylamino]-N-(3-propan-2-yloxypropyl)acetamide
CID 102636534
2-(dimethylamino)-N-(3-propan-2-yloxypropyl)acetamide
CID 156560781
N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide
CID 54989176
N-[2-(cyclohexen-1-yl)ethyl]-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635191
2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide
CID 106632199
2-[2-methoxyethyl(pyrrolidin-2-ylmethyl)amino]-N-(3-methoxypropyl)acetamide
CID 106617530
N-butan-2-yl-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614096
2-[cyclopropyl(piperidin-2-ylmethyl)amino]-N-(3-methoxypropyl)propanamide
CID 106631734
2-methyl-3-[methyl-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]amino]propanoic acid
CID 55007746

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide?
The IUPAC name of 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide (CID 106635112) is 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide.
What is the SMILES notation for 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide?
The canonical SMILES for 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide is CC(C)OCCCNC(=O)CN(C)CC1CCCCN1.
What is the InChIKey of 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide?
The InChIKey is XVPWHVMYDXPGDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2/c1-13(2)20-10-6-9-17-15(19)12-18(3)11-14-7-4-5-8-16-14/h13-14,16H,4-12H2,1-3H3,(H,17,19).
What are the key properties of 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide?
2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide has a molecular weight of 285.43 g/mol, XLogP of 0.99, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(piperidin-2-ylmethyl)amino]-N-(3-propan-2-yloxypropyl)acetamide is sourced from PubChem (CID 106635112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).