2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide

C11H22N2O4 — CID 114009223

IUPAC2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide
SMILESO=C(CNC1CCCC1)NC(CO)(CO)CO
InChIInChI=1S/C11H22N2O4/c14-6-11(7-15,8-16)13-10(17)5-12-9-3-1-2-4-9/h9,12,14-16H,1-8H2,(H,13,17)
InChIKeyVDPKMCNAPHZPHH-UHFFFAOYSA-N
MW246.31 g/mol
LogP-1.65
Rot. Bonds7

About 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide

2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide (PubChem CID 114009223) has the molecular formula C11H22N2O4 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide
PubChem CID114009223
Molecular FormulaC11H22N2O4
Molecular Weight246.31 g/mol
Exact Mass246.16
IUPAC Name2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide
SMILESO=C(CNC1CCCC1)NC(CO)(CO)CO
InChIInChI=1S/C11H22N2O4/c14-6-11(7-15,8-16)13-10(17)5-12-9-3-1-2-4-9/h9,12,14-16H,1-8H2,(H,13,17)
InChIKeyVDPKMCNAPHZPHH-UHFFFAOYSA-N
XLogP-1.65
TPSA101.82 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 5-1.65
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

2-(cyclopentylamino)-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]acetamide
CID 114010606
2-(cyclopentylamino)-N-(2,3-dihydroxy-2-methylpropyl)acetamide
CID 66186275
2-(cyclooctylamino)-N-methylacetamide
CID 28575796
2-[[2-(cyclopentylamino)acetyl]amino]acetic acid
CID 61158187
2-(cyclopentylamino)-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 82724225
2-(cyclooctylamino)-N-ethylacetamide
CID 28575760
2-(cyclohexylamino)-N-propan-2-ylacetamide
CID 28565007
N-carbamoyl-2-(cycloheptylamino)acetamide
CID 43236721
2-(cyclododecylamino)-N-ethylacetamide
CID 43399943
1-(cyclopentylamino)but-3-en-2-one
CID 116559036
2-(cyclopentylamino)-N-(2,2,3-trimethylbutyl)acetamide
CID 114100118
2-(cyclohexylamino)-N-(cyclopropylmethyl)acetamide
CID 28565073

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide?
The IUPAC name of 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide (CID 114009223) is 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide.
What is the SMILES notation for 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide?
The canonical SMILES for 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide is O=C(CNC1CCCC1)NC(CO)(CO)CO.
What is the InChIKey of 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide?
The InChIKey is VDPKMCNAPHZPHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4/c14-6-11(7-15,8-16)13-10(17)5-12-9-3-1-2-4-9/h9,12,14-16H,1-8H2,(H,13,17).
What are the key properties of 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide?
2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide has a molecular weight of 246.31 g/mol, XLogP of -1.65, 7 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide is sourced from PubChem (CID 114009223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).