N-[3-(oxolan-3-yl)propyl]cyclopropanamine

C10H19NO — CID 64504217

IUPACN-[3-(oxolan-3-yl)propyl]cyclopropanamine
SMILESC(CNC1CC1)CC1CCOC1
InChIInChI=1S/C10H19NO/c1(6-11-10-3-4-10)2-9-5-7-12-8-9/h9-11H,1-8H2
InChIKeyJVRAMFCMMMELMR-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.56
Rot. Bonds5

About N-[3-(oxolan-3-yl)propyl]cyclopropanamine

N-[3-(oxolan-3-yl)propyl]cyclopropanamine (PubChem CID 64504217) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-[3-(oxolan-3-yl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[3-(oxolan-3-yl)propyl]cyclopropanamine
PubChem CID64504217
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-[3-(oxolan-3-yl)propyl]cyclopropanamine
SMILESC(CNC1CC1)CC1CCOC1
InChIInChI=1S/C10H19NO/c1(6-11-10-3-4-10)2-9-5-7-12-8-9/h9-11H,1-8H2
InChIKeyJVRAMFCMMMELMR-UHFFFAOYSA-N
XLogP1.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(oxolan-3-yl)ethyl]cyclohexanamine
CID 103878945
N-[[(3S)-oxolan-3-yl]methyl]cyclopropanamine
CID 30427697
3-(oxolan-3-yl)-N-propan-2-ylpropan-1-amine
CID 64503037
(3S)-N-[3-(3-methylcyclobutyl)propyl]oxolan-3-amine
CID 167310676
N-[4-(oxolan-3-ylmethoxy)pentyl]cyclopropanamine
CID 62486502
2,2-dimethyl-N-[2-(oxolan-3-yl)ethyl]-1,3-dioxan-5-amine
CID 102673023
1-[4-[2-(oxolan-3-yl)ethylamino]piperidin-1-yl]ethanone
CID 113415221
CID 88999867
CID 88999867
N-[2-(oxolan-3-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 113424537
3-methyl-N-[4-(oxan-4-yl)butyl]cyclopentan-1-amine
CID 114191125
3-cyclopentyl-N-(oxolan-3-ylmethyl)propan-1-amine
CID 115887250
1-(2-methyl-6-propan-2-ylpyrimidin-4-yl)-N-[3-(oxolan-3-yl)propyl]piperidin-4-amine
CID 72891852

Frequently Asked Questions

What is the IUPAC name of N-[3-(oxolan-3-yl)propyl]cyclopropanamine?
The IUPAC name of N-[3-(oxolan-3-yl)propyl]cyclopropanamine (CID 64504217) is N-[3-(oxolan-3-yl)propyl]cyclopropanamine.
What is the SMILES notation for N-[3-(oxolan-3-yl)propyl]cyclopropanamine?
The canonical SMILES for N-[3-(oxolan-3-yl)propyl]cyclopropanamine is C(CNC1CC1)CC1CCOC1.
What is the InChIKey of N-[3-(oxolan-3-yl)propyl]cyclopropanamine?
The InChIKey is JVRAMFCMMMELMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1(6-11-10-3-4-10)2-9-5-7-12-8-9/h9-11H,1-8H2.
What are the key properties of N-[3-(oxolan-3-yl)propyl]cyclopropanamine?
N-[3-(oxolan-3-yl)propyl]cyclopropanamine has a molecular weight of 169.27 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(oxolan-3-yl)propyl]cyclopropanamine is sourced from PubChem (CID 64504217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).