1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine

C9H17NO — CID 3607647

IUPAC1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine
SMILESC1COC(CNCC2CC2)C1
InChIInChI=1S/C9H17NO/c1-2-9(11-5-1)7-10-6-8-3-4-8/h8-10H,1-7H2
InChIKeyDMMCSRZAOOXDCN-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.16
Rot. Bonds4

About 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine

1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine (PubChem CID 3607647) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine
PubChem CID3607647
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine
SMILESC1COC(CNCC2CC2)C1
InChIInChI=1S/C9H17NO/c1-2-9(11-5-1)7-10-6-8-3-4-8/h8-10H,1-7H2
InChIKeyDMMCSRZAOOXDCN-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(oxiran-2-ylmethyl)-1-(oxolan-2-yl)methanamine
CID 126662658
1-(3-methylcyclopentyl)-N-(oxolan-2-ylmethyl)methanamine
CID 107411733
1-[(3R)-oxan-3-yl]-N-[[(2S)-oxolan-2-yl]methyl]methanamine
CID 93449844
3-[(oxolan-2-ylmethylamino)methyl]cyclohexan-1-amine
CID 63046122
3-cyclopropyl-N-(oxolan-2-ylmethyl)propan-1-amine
CID 102551342
N-(oxan-2-ylmethyl)-1-(oxolan-3-yl)methanamine
CID 61038711
1-cyclopropyl-N-(1,3-dioxan-2-ylmethyl)methanamine
CID 102849696
methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate
CID 28585559
1-cyclopropyl-N-(1,3-dioxan-4-ylmethyl)methanamine
CID 81101660
N-(oxan-2-ylmethyl)-1-pyrrolidin-3-ylmethanamine
CID 63006474
2-cyclohexyl-N-(oxolan-2-ylmethyl)ethanamine
CID 60920753
N-[(5-methyloxolan-2-yl)methyl]-1-(oxolan-2-yl)methanamine
CID 81330041

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine?
The IUPAC name of 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine (CID 3607647) is 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine.
What is the SMILES notation for 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine?
The canonical SMILES for 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine is C1COC(CNCC2CC2)C1.
What is the InChIKey of 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine?
The InChIKey is DMMCSRZAOOXDCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-2-9(11-5-1)7-10-6-8-3-4-8/h8-10H,1-7H2.
What are the key properties of 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine?
1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine has a molecular weight of 155.24 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine is sourced from PubChem (CID 3607647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).