N-(cyclopropylmethyl)-3-methyloxan-3-amine

C10H19NO — CID 103897448

IUPACN-(cyclopropylmethyl)-3-methyloxan-3-amine
SMILESCC1(NCC2CC2)CCCOC1
InChIInChI=1S/C10H19NO/c1-10(5-2-6-12-8-10)11-7-9-3-4-9/h9,11H,2-8H2,1H3
InChIKeyQKGBJBUMDASBPS-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.56
Rot. Bonds3

About N-(cyclopropylmethyl)-3-methyloxan-3-amine

N-(cyclopropylmethyl)-3-methyloxan-3-amine (PubChem CID 103897448) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-methyloxan-3-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-methyloxan-3-amine
PubChem CID103897448
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-(cyclopropylmethyl)-3-methyloxan-3-amine
SMILESCC1(NCC2CC2)CCCOC1
InChIInChI=1S/C10H19NO/c1-10(5-2-6-12-8-10)11-7-9-3-4-9/h9,11H,2-8H2,1H3
InChIKeyQKGBJBUMDASBPS-UHFFFAOYSA-N
XLogP1.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-methyloxan-3-amine?
The IUPAC name of N-(cyclopropylmethyl)-3-methyloxan-3-amine (CID 103897448) is N-(cyclopropylmethyl)-3-methyloxan-3-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-3-methyloxan-3-amine?
The canonical SMILES for N-(cyclopropylmethyl)-3-methyloxan-3-amine is CC1(NCC2CC2)CCCOC1.
What is the InChIKey of N-(cyclopropylmethyl)-3-methyloxan-3-amine?
The InChIKey is QKGBJBUMDASBPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-10(5-2-6-12-8-10)11-7-9-3-4-9/h9,11H,2-8H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-3-methyloxan-3-amine?
N-(cyclopropylmethyl)-3-methyloxan-3-amine has a molecular weight of 169.27 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-methyloxan-3-amine is sourced from PubChem (CID 103897448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).