2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide

C15H29N3O — CID 65079766

IUPAC2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide
SMILESCC1CCCC(NC2CCN(CC(N)=O)CC2)CC1
InChIInChI=1S/C15H29N3O/c1-12-3-2-4-13(6-5-12)17-14-7-9-18(10-8-14)11-15(16)19/h12-14,17H,2-11H2,1H3,(H2,16,19)
InChIKeyLOXNXJMDEIVLQX-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.49
Rot. Bonds4

About 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide

2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide (PubChem CID 65079766) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide
PubChem CID65079766
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide
SMILESCC1CCCC(NC2CCN(CC(N)=O)CC2)CC1
InChIInChI=1S/C15H29N3O/c1-12-3-2-4-13(6-5-12)17-14-7-9-18(10-8-14)11-15(16)19/h12-14,17H,2-11H2,1H3,(H2,16,19)
InChIKeyLOXNXJMDEIVLQX-UHFFFAOYSA-N
XLogP1.49
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(3-methylcyclobutyl)amino]piperidin-1-yl]acetamide
CID 104859652
2-[4-[(2,5-dimethylcyclohexyl)amino]piperidin-1-yl]acetamide
CID 64761265
2-[4-[(4,4-dimethylcycloheptyl)amino]piperidin-1-yl]acetamide
CID 65083386
2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]acetamide
CID 43746779
2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide
CID 64759422
N-methyl-2-[4-[(3-methylcyclohexyl)amino]piperidin-1-yl]acetamide
CID 43435274
2-[4-[(1-oxothian-4-yl)amino]piperidin-1-yl]acetamide
CID 54981867
2-[4-[(3-methoxycyclobutyl)amino]piperidin-1-yl]acetamide
CID 104870851
2-[4-[(2,4,4-trimethylcyclopentyl)amino]piperidin-1-yl]acetamide
CID 106662205
N-cyclopentyl-4-methylcycloheptan-1-amine
CID 65081210
2-[4-(cyclopropylamino)piperidin-1-yl]acetic acid
CID 145176317
1-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-methylcyclohexane-1-carboxamide
CID 64551452

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide (CID 65079766) is 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide is CC1CCCC(NC2CCN(CC(N)=O)CC2)CC1.
What is the InChIKey of 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide?
The InChIKey is LOXNXJMDEIVLQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12-3-2-4-13(6-5-12)17-14-7-9-18(10-8-14)11-15(16)19/h12-14,17H,2-11H2,1H3,(H2,16,19).
What are the key properties of 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide?
2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide has a molecular weight of 267.42 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 65079766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).