N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide

C13H24N4O2 — CID 43162551

IUPACN-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide
SMILESO=C(CN1CCCNCC1)NC(=O)NC1CCCC1
InChIInChI=1S/C13H24N4O2/c18-12(10-17-8-3-6-14-7-9-17)16-13(19)15-11-4-1-2-5-11/h11,14H,1-10H2,(H2,15,16,18,19)
InChIKeyRJOUKVVBOBGZKE-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.05
Rot. Bonds3

About N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide

N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide (PubChem CID 43162551) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide.

Molecular Properties

Compound NameN-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide
PubChem CID43162551
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC NameN-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide
SMILESO=C(CN1CCCNCC1)NC(=O)NC1CCCC1
InChIInChI=1S/C13H24N4O2/c18-12(10-17-8-3-6-14-7-9-17)16-13(19)15-11-4-1-2-5-11/h11,14H,1-10H2,(H2,15,16,18,19)
InChIKeyRJOUKVVBOBGZKE-UHFFFAOYSA-N
XLogP0.05
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopropylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide
CID 43162505
2-(azepan-1-yl)-N-(cyclopentylcarbamoyl)acetamide
CID 8895713
N-cyclopropyl-2-[[2-(1,4-diazepan-1-yl)acetyl]amino]acetamide
CID 62839148
2-(4-aminopiperidin-1-yl)-N-(cyclohexylcarbamoyl)acetamide
CID 43556566
N-(cyclohexylcarbamoyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2655086
N-cyclohexyl-3-(1,4-diazepan-1-yl)propanamide
CID 43162430
2-[(3R)-3-aminopiperidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide
CID 102977459
N-[1-[2-(cyclohexylcarbamoylamino)-2-oxoethyl]piperidin-4-yl]cyclohexanecarboxamide
CID 86860953
2-(1,4-diazepan-1-yl)-N-(propylcarbamoyl)acetamide;hydrochloride
CID 119906348
2-(1,4-diazepan-1-yl)-N-(1-methylpiperidin-3-yl)acetamide
CID 62838906
3-[[2-(1,4-diazepan-1-yl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 63043303
N-cyclopropyl-4-[[2-(1,4-diazepan-1-yl)acetyl]amino]butanamide
CID 79401234

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide?
The IUPAC name of N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide (CID 43162551) is N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide.
What is the SMILES notation for N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide?
The canonical SMILES for N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide is O=C(CN1CCCNCC1)NC(=O)NC1CCCC1.
What is the InChIKey of N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide?
The InChIKey is RJOUKVVBOBGZKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c18-12(10-17-8-3-6-14-7-9-17)16-13(19)15-11-4-1-2-5-11/h11,14H,1-10H2,(H2,15,16,18,19).
What are the key properties of N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide?
N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide has a molecular weight of 268.36 g/mol, XLogP of 0.05, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide is sourced from PubChem (CID 43162551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).