N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine

C9H19NO — CID 103984710

IUPACN-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine
SMILESCOCC1(CNC(C)C)CC1
InChIInChI=1S/C9H19NO/c1-8(2)10-6-9(4-5-9)7-11-3/h8,10H,4-7H2,1-3H3
InChIKeySFMRKUJHAJVTBX-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.41
Rot. Bonds5

About N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine

N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine (PubChem CID 103984710) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine
PubChem CID103984710
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine
SMILESCOCC1(CNC(C)C)CC1
InChIInChI=1S/C9H19NO/c1-8(2)10-6-9(4-5-9)7-11-3/h8,10H,4-7H2,1-3H3
InChIKeySFMRKUJHAJVTBX-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine?
The IUPAC name of N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine (CID 103984710) is N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine is COCC1(CNC(C)C)CC1.
What is the InChIKey of N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine?
The InChIKey is SFMRKUJHAJVTBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(2)10-6-9(4-5-9)7-11-3/h8,10H,4-7H2,1-3H3.
What are the key properties of N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine?
N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine has a molecular weight of 157.26 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine is sourced from PubChem (CID 103984710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).