N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine

C9H17NO — CID 3607647

IUPAC1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine
SMILESC1CC(OC1)CNCC2CC2
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
LogP0.90
Rot. Bonds4

About N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine

N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine (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 NameN-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine
PubChem CID3607647
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine
SMILESC1CC(OC1)CNCC2CC2
InChIInChI=1S/C9H17NO/c1-2-9(11-5-1)7-10-6-8-3-4-8/h8-10H,1-7H2
InChIKeyDMMCSRZAOOXDCN-UHFFFAOYSA-N
XLogP0.90
TPSA21.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity123

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine?
The IUPAC name of N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine (CID 3607647) is 1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine.
What is the SMILES notation for N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine?
The canonical SMILES for N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine is C1CC(OC1)CNCC2CC2.
What is the InChIKey of N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine?
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 N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine?
N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine has a molecular weight of 155.24 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine is sourced from PubChem (CID 3607647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).