N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide

C15H31N3O2 — CID 83199097

IUPACN,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide
SMILESCC(C)COCCCNC1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C15H31N3O2/c1-13(2)12-20-11-5-8-16-14-6-9-18(10-7-14)15(19)17(3)4/h13-14,16H,5-12H2,1-4H3
InChIKeyQNHHTICAZJAIBJ-UHFFFAOYSA-N
MW285.43 g/mol
LogP1.78
Rot. Bonds7

About N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide

N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide (PubChem CID 83199097) has the molecular formula C15H31N3O2 and a molecular weight of 285.43 g/mol. Its IUPAC name is N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide
PubChem CID83199097
Molecular FormulaC15H31N3O2
Molecular Weight285.43 g/mol
Exact Mass285.24
IUPAC NameN,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide
SMILESCC(C)COCCCNC1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C15H31N3O2/c1-13(2)12-20-11-5-8-16-14-6-9-18(10-7-14)15(19)17(3)4/h13-14,16H,5-12H2,1-4H3
InChIKeyQNHHTICAZJAIBJ-UHFFFAOYSA-N
XLogP1.78
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[(5-hydroxy-4-methylpentyl)amino]-N,N-dimethylpiperidine-1-carboxamide
CID 103912870
N-[3-(2-methylpropoxy)propyl]cyclopentanamine
CID 28681533
4-(cyclopropylmethylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 115307162
N-[4-(2-methylpropoxy)butyl]cyclopropanamine
CID 62445498
N,N-dimethyl-4-[[3-oxo-3-(propan-2-ylamino)propyl]amino]piperidine-1-carboxamide
CID 115899595
1-[4-(3-propan-2-yloxypropylamino)piperidin-1-yl]ethanone
CID 25219591
4-(but-3-ynylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 83262365
methyl 2-[[1-(dimethylcarbamoyl)piperidin-4-yl]amino]acetate
CID 83224585
N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide
CID 83199504
1-[4-[3-(2-hydroxyethoxy)propylamino]piperidin-1-yl]ethanone
CID 103992533
4-(1-methoxybutan-2-ylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 83206989
1-[4-[(5-hydroxy-4-methylpentyl)amino]piperidin-1-yl]ethanone
CID 103859428

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide?
The IUPAC name of N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide (CID 83199097) is N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide is CC(C)COCCCNC1CCN(C(=O)N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide?
The InChIKey is QNHHTICAZJAIBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2/c1-13(2)12-20-11-5-8-16-14-6-9-18(10-7-14)15(19)17(3)4/h13-14,16H,5-12H2,1-4H3.
What are the key properties of N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide?
N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide has a molecular weight of 285.43 g/mol, XLogP of 1.78, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[3-(2-methylpropoxy)propylamino]piperidine-1-carboxamide is sourced from PubChem (CID 83199097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).