3-(cyclopentylmethylamino)-2-hydroxypropanamide

C9H18N2O2 — CID 106171619

IUPAC3-(cyclopentylmethylamino)-2-hydroxypropanamide
SMILESNC(=O)C(O)CNCC1CCCC1
InChIInChI=1S/C9H18N2O2/c10-9(13)8(12)6-11-5-7-3-1-2-4-7/h7-8,11-12H,1-6H2,(H2,10,13)
InChIKeySCILJBKYXLDHPI-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.39
Rot. Bonds5

About 3-(cyclopentylmethylamino)-2-hydroxypropanamide

3-(cyclopentylmethylamino)-2-hydroxypropanamide (PubChem CID 106171619) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 3-(cyclopentylmethylamino)-2-hydroxypropanamide.

Molecular Properties

Compound Name3-(cyclopentylmethylamino)-2-hydroxypropanamide
PubChem CID106171619
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name3-(cyclopentylmethylamino)-2-hydroxypropanamide
SMILESNC(=O)C(O)CNCC1CCCC1
InChIInChI=1S/C9H18N2O2/c10-9(13)8(12)6-11-5-7-3-1-2-4-7/h7-8,11-12H,1-6H2,(H2,10,13)
InChIKeySCILJBKYXLDHPI-UHFFFAOYSA-N
XLogP-0.39
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cycloheptylmethylamino)-2-hydroxypropanamide
CID 106170462
2-hydroxy-3-(oxolan-2-ylmethylamino)propanamide
CID 106171048
3-(cyclopentylmethylamino)propane-1,2-diol
CID 60900461
3-(cycloheptylmethylamino)propane-1,2-diol
CID 66176972
4-(cyclohexylmethylamino)-3-hydroxybutanoic acid
CID 103237864
methyl (2R)-3-(cycloheptylmethylamino)-2-methylpropanoate
CID 129354214
1-N-(cyclopentylmethyl)propane-1,2-diamine
CID 115196604
3-(2,5-dihydrofuran-2-ylmethylamino)-2-hydroxypropanamide
CID 118235005
1-(cyclopentylmethylamino)-3-methylbutan-2-ol
CID 115907214
2-amino-3-[[2-(hydroxymethyl)cyclohexyl]methylamino]propanamide
CID 103255271
2-(cyclohexylmethylamino)propanamide
CID 43216154
methyl 5-(cyclopentylmethylamino)-4-hydroxypentanoate
CID 115123592

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylmethylamino)-2-hydroxypropanamide?
The IUPAC name of 3-(cyclopentylmethylamino)-2-hydroxypropanamide (CID 106171619) is 3-(cyclopentylmethylamino)-2-hydroxypropanamide.
What is the SMILES notation for 3-(cyclopentylmethylamino)-2-hydroxypropanamide?
The canonical SMILES for 3-(cyclopentylmethylamino)-2-hydroxypropanamide is NC(=O)C(O)CNCC1CCCC1.
What is the InChIKey of 3-(cyclopentylmethylamino)-2-hydroxypropanamide?
The InChIKey is SCILJBKYXLDHPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c10-9(13)8(12)6-11-5-7-3-1-2-4-7/h7-8,11-12H,1-6H2,(H2,10,13).
What are the key properties of 3-(cyclopentylmethylamino)-2-hydroxypropanamide?
3-(cyclopentylmethylamino)-2-hydroxypropanamide has a molecular weight of 186.25 g/mol, XLogP of -0.39, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylmethylamino)-2-hydroxypropanamide is sourced from PubChem (CID 106171619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).