2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide

C14H26N4O2 — CID 60963214

IUPAC2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide
SMILESNC(=O)CN1CCCN(C(=O)CNC2CCCC2)CC1
InChIInChI=1S/C14H26N4O2/c15-13(19)11-17-6-3-7-18(9-8-17)14(20)10-16-12-4-1-2-5-12/h12,16H,1-11H2,(H2,15,19)
InChIKeyLGPZZRPIFBHASB-UHFFFAOYSA-N
MW282.39 g/mol
LogP-0.46
Rot. Bonds5

About 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide

2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide (PubChem CID 60963214) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide
PubChem CID60963214
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide
SMILESNC(=O)CN1CCCN(C(=O)CNC2CCCC2)CC1
InChIInChI=1S/C14H26N4O2/c15-13(19)11-17-6-3-7-18(9-8-17)14(20)10-16-12-4-1-2-5-12/h12,16H,1-11H2,(H2,15,19)
InChIKeyLGPZZRPIFBHASB-UHFFFAOYSA-N
XLogP-0.46
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[2-(cyclopropylamino)acetyl]-1,4-diazepan-1-yl]acetamide
CID 54873492
2-[4-[2-(cyclopentylamino)acetyl]piperazin-1-yl]acetic acid
CID 61161596
2-(cyclohexylamino)-1-(4-ethylpiperazin-1-yl)ethanone
CID 108993559
2-[4-[2-(butan-2-ylamino)acetyl]-1,4-diazepan-1-yl]acetamide
CID 54873506
4-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]piperidine-1-carboxamide
CID 113352679
2-[4-[(3R)-3-cyclohexylbutanoyl]piperazin-1-yl]acetamide
CID 95159173
2-(azetidin-1-yl)acetamide
CID 18923030
4-[2-(cyclohexylamino)acetyl]piperazine-1-carbaldehyde
CID 108993560
4-[[2-(azetidin-1-yl)-2-oxoethyl]amino]cyclohexane-1-carboxylic acid
CID 60809874
2-(cyclopentylamino)-1-(4,4-diethylpiperidin-1-yl)ethanone
CID 63163229
2-[4-(2-bromobutanoyl)-1,4-diazepan-1-yl]acetamide
CID 62855599
2-[4-(2-aminocyclopentanecarbonyl)-1,4-diazepan-1-yl]acetamide
CID 64822046

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide?
The IUPAC name of 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide (CID 60963214) is 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide.
What is the SMILES notation for 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide?
The canonical SMILES for 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide is NC(=O)CN1CCCN(C(=O)CNC2CCCC2)CC1.
What is the InChIKey of 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide?
The InChIKey is LGPZZRPIFBHASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c15-13(19)11-17-6-3-7-18(9-8-17)14(20)10-16-12-4-1-2-5-12/h12,16H,1-11H2,(H2,15,19).
What are the key properties of 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide?
2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide has a molecular weight of 282.39 g/mol, XLogP of -0.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-1-yl]acetamide is sourced from PubChem (CID 60963214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).