N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine

C14H27NO — CID 106930748

IUPACN-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine
SMILESCCCC(C)(CNC1CC1)COCC1CC1
InChIInChI=1S/C14H27NO/c1-3-8-14(2,10-15-13-6-7-13)11-16-9-12-4-5-12/h12-13,15H,3-11H2,1-2H3
InChIKeyYKBBZHPOAJZYNB-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds9

About N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine

N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine (PubChem CID 106930748) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine
PubChem CID106930748
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine
SMILESCCCC(C)(CNC1CC1)COCC1CC1
InChIInChI=1S/C14H27NO/c1-3-8-14(2,10-15-13-6-7-13)11-16-9-12-4-5-12/h12-13,15H,3-11H2,1-2H3
InChIKeyYKBBZHPOAJZYNB-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine
CID 106930750
N-[2-(cyclopropylmethoxymethyl)-2-methylbut-3-enyl]cyclopropanamine
CID 106931005
N-(5-methoxy-2-methyl-2-propylpentyl)cyclopropanamine
CID 62723418
N-[2-methyl-2-[2-(2-methylpropoxy)ethyl]pentyl]cyclopropanamine
CID 106456863
N-(6-methoxy-2-methyl-2-propylhexyl)cyclopropanamine
CID 104649334
N-[2-methyl-2-(2-propan-2-yloxyethyl)pentyl]cyclopropanamine
CID 62725819
N-[2-methyl-2-[2-(3-methylbutoxy)ethyl]pentyl]cyclopropanamine
CID 55106599
N,N'-dicyclopropyl-N',2-dimethyl-2-propylpropane-1,3-diamine
CID 62262170
N-cyclopropyl-N',2-dimethyl-N'-propan-2-yl-2-propylpropane-1,3-diamine
CID 62263755
N-[2-(azocan-1-ylmethyl)-2-methylpentyl]cyclopropanamine
CID 62261563
N-[2-[(3-ethylpyrrolidin-1-yl)methyl]-2-methylpentyl]cyclopropanamine
CID 113418855
1-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-ethylamino]-2-methylpropan-2-ol
CID 79379941

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine?
The IUPAC name of N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine (CID 106930748) is N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine.
What is the SMILES notation for N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine?
The canonical SMILES for N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine is CCCC(C)(CNC1CC1)COCC1CC1.
What is the InChIKey of N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine?
The InChIKey is YKBBZHPOAJZYNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-3-8-14(2,10-15-13-6-7-13)11-16-9-12-4-5-12/h12-13,15H,3-11H2,1-2H3.
What are the key properties of N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine?
N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine is sourced from PubChem (CID 106930748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).