7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide

C15H29N3O — CID 119879080

IUPAC7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide
SMILESC=CCN1CCC(NC(=O)CCCCCCN)CC1
InChIInChI=1S/C15H29N3O/c1-2-11-18-12-8-14(9-13-18)17-15(19)7-5-3-4-6-10-16/h2,14H,1,3-13,16H2,(H,17,19)
InChIKeyFFDZFSYAVAKENH-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.66
Rot. Bonds9

About 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide

7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide (PubChem CID 119879080) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide.

Molecular Properties

Compound Name7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide
PubChem CID119879080
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide
SMILESC=CCN1CCC(NC(=O)CCCCCCN)CC1
InChIInChI=1S/C15H29N3O/c1-2-11-18-12-8-14(9-13-18)17-15(19)7-5-3-4-6-10-16/h2,14H,1,3-13,16H2,(H,17,19)
InChIKeyFFDZFSYAVAKENH-UHFFFAOYSA-N
XLogP1.66
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-amino-N-(1-propylpiperidin-4-yl)hexanamide
CID 61276354
7-amino-N-(1-methylpiperidin-4-yl)heptanamide
CID 43373568
3-phenyl-N-(1-prop-2-enylpiperidin-4-yl)propanamide
CID 51081790
7-amino-N-[1-[(4-bromophenyl)methyl]piperidin-4-yl]heptanamide
CID 119899075
4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide
CID 43711759
4-(7-aminoheptanoylamino)cyclohexane-1-carboxylic acid
CID 61160664
N,N'-dicyclopropyldecanediamide
CID 4668836
(2S)-2-amino-N-(1-prop-2-enylpiperidin-4-yl)butanamide
CID 119879124
7-amino-N-(1-phenylpyrrolidin-3-yl)heptanamide
CID 119861676
3-amino-3-phenyl-N-(1-prop-2-enylpiperidin-4-yl)propanamide
CID 119953733
4-(7-aminoheptanoylamino)-N-phenylpiperidine-1-carboxamide
CID 119700221
6-amino-N-(4-methylcycloheptyl)hexanamide
CID 114100037

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide?
The IUPAC name of 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide (CID 119879080) is 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide.
What is the SMILES notation for 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide?
The canonical SMILES for 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide is C=CCN1CCC(NC(=O)CCCCCCN)CC1.
What is the InChIKey of 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide?
The InChIKey is FFDZFSYAVAKENH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-2-11-18-12-8-14(9-13-18)17-15(19)7-5-3-4-6-10-16/h2,14H,1,3-13,16H2,(H,17,19).
What are the key properties of 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide?
7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide has a molecular weight of 267.42 g/mol, XLogP of 1.66, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide is sourced from PubChem (CID 119879080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).