N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine

C13H27NO — CID 103284483

IUPACN-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine
SMILESCCCC(C)COCC(C)CNC1CC1
InChIInChI=1S/C13H27NO/c1-4-5-11(2)9-15-10-12(3)8-14-13-6-7-13/h11-14H,4-10H2,1-3H3
InChIKeyFDLXZIFBTJRTOM-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.83
Rot. Bonds9

About N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine

N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine (PubChem CID 103284483) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine
PubChem CID103284483
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC NameN-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine
SMILESCCCC(C)COCC(C)CNC1CC1
InChIInChI=1S/C13H27NO/c1-4-5-11(2)9-15-10-12(3)8-14-13-6-7-13/h11-14H,4-10H2,1-3H3
InChIKeyFDLXZIFBTJRTOM-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[4-(2-methylpentoxymethyl)phenyl]propyl]cyclopropanamine
CID 103285688
N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine
CID 103075099
1-(cyclopropylamino)-2-methyl-3-(2-methylpentoxy)propan-2-ol
CID 103283560
N-[3-(1-ethoxypropan-2-yloxy)-2-methylpropyl]cyclopropanamine
CID 103489367
2-(cyclopropylamino)-3-(2-methylpentoxy)propanoic acid
CID 103284916
N-(2-methyl-3-pent-4-enoxypropyl)cyclopropanamine
CID 103074881
N-[[3-(2-methylpentoxymethyl)phenyl]methyl]cyclopropanamine
CID 103285638
2-methoxy-1-[4-(2-methylpentylamino)piperidin-1-yl]ethanone
CID 43747502
N-(2,3-dimethyl-4-propoxybutyl)cyclopropanamine
CID 81015534
N-[(4S)-2,4-dimethylhexyl]cyclopropanamine
CID 142895112
3-ethylsulfanyl-N-(2-methylpentyl)cyclopentan-1-amine
CID 115907891
N-[2-(2-ethoxyethyl)pentyl]cyclopropanamine
CID 62528732

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine?
The IUPAC name of N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine (CID 103284483) is N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine.
What is the SMILES notation for N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine?
The canonical SMILES for N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine is CCCC(C)COCC(C)CNC1CC1.
What is the InChIKey of N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine?
The InChIKey is FDLXZIFBTJRTOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-4-5-11(2)9-15-10-12(3)8-14-13-6-7-13/h11-14H,4-10H2,1-3H3.
What are the key properties of N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine?
N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine has a molecular weight of 213.36 g/mol, XLogP of 2.83, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-3-(2-methylpentoxy)propyl]cyclopropanamine is sourced from PubChem (CID 103284483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).