6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide

C15H31N3O — CID 54870299

IUPAC6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide
SMILESCC(C)N1CCC(N(C)C(=O)CCCCCN)CC1
InChIInChI=1S/C15H31N3O/c1-13(2)18-11-8-14(9-12-18)17(3)15(19)7-5-4-6-10-16/h13-14H,4-12,16H2,1-3H3
InChIKeyQKWXRSCFNBMYGK-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.84
Rot. Bonds7

About 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide

6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide (PubChem CID 54870299) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide.

Molecular Properties

Compound Name6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide
PubChem CID54870299
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide
SMILESCC(C)N1CCC(N(C)C(=O)CCCCCN)CC1
InChIInChI=1S/C15H31N3O/c1-13(2)18-11-8-14(9-12-18)17(3)15(19)7-5-4-6-10-16/h13-14H,4-12,16H2,1-3H3
InChIKeyQKWXRSCFNBMYGK-UHFFFAOYSA-N
XLogP1.84
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.84
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

3-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide;dihydrochloride
CID 119842368
6-[methyl-(1-propan-2-ylpiperidin-4-yl)amino]-6-oxohexanoic acid
CID 60953422
6-amino-N-cyclopentyl-N-methylhexanamide
CID 43267226
7-amino-N-cycloheptyl-N-methylheptanamide
CID 43614064
7-amino-N-cyclooctyl-N-methylheptanamide
CID 119763844
7-amino-N-methyl-N-(oxan-4-yl)heptanamide
CID 43611104
6-amino-N-methyl-N-(oxan-4-yl)hexanamide
CID 43611096
4-amino-N-methyl-N-(1-methylpiperidin-4-yl)butanamide
CID 60731508
3-(cyclopropylamino)-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
CID 54870177
7-amino-N-methyl-N-(3-methylcyclohexyl)heptanamide
CID 54949044
N-methyl-2-(methylamino)-N-(1-propan-2-ylpiperidin-4-yl)acetamide;dihydrochloride
CID 119842334
2-(cyclopropylmethylamino)-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 54870366

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide?
The IUPAC name of 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide (CID 54870299) is 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide.
What is the SMILES notation for 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide?
The canonical SMILES for 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide is CC(C)N1CCC(N(C)C(=O)CCCCCN)CC1.
What is the InChIKey of 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide?
The InChIKey is QKWXRSCFNBMYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-13(2)18-11-8-14(9-12-18)17(3)15(19)7-5-4-6-10-16/h13-14H,4-12,16H2,1-3H3.
What are the key properties of 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide?
6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide has a molecular weight of 269.43 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide is sourced from PubChem (CID 54870299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).