3-[(1-hydroxycyclohexyl)methylamino]propanamide

C10H20N2O2 — CID 60909908

IUPAC3-[(1-hydroxycyclohexyl)methylamino]propanamide
SMILESNC(=O)CCNCC1(O)CCCCC1
InChIInChI=1S/C10H20N2O2/c11-9(13)4-7-12-8-10(14)5-2-1-3-6-10/h12,14H,1-8H2,(H2,11,13)
InChIKeyMURUZUODIBSAPQ-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.15
Rot. Bonds5

About 3-[(1-hydroxycyclohexyl)methylamino]propanamide

3-[(1-hydroxycyclohexyl)methylamino]propanamide (PubChem CID 60909908) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-[(1-hydroxycyclohexyl)methylamino]propanamide.

Molecular Properties

Compound Name3-[(1-hydroxycyclohexyl)methylamino]propanamide
PubChem CID60909908
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-[(1-hydroxycyclohexyl)methylamino]propanamide
SMILESNC(=O)CCNCC1(O)CCCCC1
InChIInChI=1S/C10H20N2O2/c11-9(13)4-7-12-8-10(14)5-2-1-3-6-10/h12,14H,1-8H2,(H2,11,13)
InChIKeyMURUZUODIBSAPQ-UHFFFAOYSA-N
XLogP0.15
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[(1-hydroxycycloheptyl)methylamino]butanamide
CID 60908501
4-[(1-hydroxycyclohexyl)methylamino]butanoic acid
CID 65108900
3-[(1-hydroxycyclopentyl)methylamino]-N-propan-2-ylpropanamide
CID 65111913
N'-hydroxy-2-[(1-hydroxycycloheptyl)methylamino]ethanimidamide
CID 77056758
4-[[(4-amino-4-oxobutyl)amino]methyl]-4-hydroxycyclohexane-1-carboxylic acid
CID 106499157
N-cyclopropyl-4-[(1-hydroxycyclohexyl)methylamino]butanamide
CID 79394707
1-[(4-hydroxybutylamino)methyl]cycloheptan-1-ol
CID 65122781
2-amino-N-[(1-hydroxycycloheptyl)methyl]acetamide
CID 65122282
N-[(1-hydroxycyclobutyl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111539371
1-[(pent-4-ynylamino)methyl]cyclohexan-1-ol
CID 115664087
1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide
CID 43553625
1-[(4-hydroxybutylamino)methyl]cyclopentan-1-ol
CID 65108735

Frequently Asked Questions

What is the IUPAC name of 3-[(1-hydroxycyclohexyl)methylamino]propanamide?
The IUPAC name of 3-[(1-hydroxycyclohexyl)methylamino]propanamide (CID 60909908) is 3-[(1-hydroxycyclohexyl)methylamino]propanamide.
What is the SMILES notation for 3-[(1-hydroxycyclohexyl)methylamino]propanamide?
The canonical SMILES for 3-[(1-hydroxycyclohexyl)methylamino]propanamide is NC(=O)CCNCC1(O)CCCCC1.
What is the InChIKey of 3-[(1-hydroxycyclohexyl)methylamino]propanamide?
The InChIKey is MURUZUODIBSAPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c11-9(13)4-7-12-8-10(14)5-2-1-3-6-10/h12,14H,1-8H2,(H2,11,13).
What are the key properties of 3-[(1-hydroxycyclohexyl)methylamino]propanamide?
3-[(1-hydroxycyclohexyl)methylamino]propanamide has a molecular weight of 200.28 g/mol, XLogP of 0.15, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-hydroxycyclohexyl)methylamino]propanamide is sourced from PubChem (CID 60909908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).