N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine

C13H26N2 — CID 63625080

IUPACN-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine
SMILESCC1CCCN(C(C)CNC2CC2)CC1
InChIInChI=1S/C13H26N2/c1-11-4-3-8-15(9-7-11)12(2)10-14-13-5-6-13/h11-14H,3-10H2,1-2H3
InChIKeyYEDCZDLBHJVADQ-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds4

About N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine

N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine (PubChem CID 63625080) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine
PubChem CID63625080
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine
SMILESCC1CCCN(C(C)CNC2CC2)CC1
InChIInChI=1S/C13H26N2/c1-11-4-3-8-15(9-7-11)12(2)10-14-13-5-6-13/h11-14H,3-10H2,1-2H3
InChIKeyYEDCZDLBHJVADQ-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methylazepan-1-yl)propyl]cyclohexanamine
CID 63627376
N-(2-piperidin-1-ylpropyl)cyclopropanamine
CID 62424338
N-[4-(4-methylazepan-1-yl)pentyl]cyclopropanamine
CID 55249022
N-[2-(azocan-1-yl)propyl]cyclopentanamine
CID 62558696
N-[2-(4-propan-2-ylpiperidin-1-yl)propyl]cyclopropanamine
CID 103503204
N-[2-(4-ethylpiperidin-1-yl)propyl]cyclopropanamine
CID 62413434
N-[2-(4-methylazepan-1-yl)-2-phenylethyl]cyclopropanamine
CID 63626845
N-[3-methyl-2-(3-methylpiperidin-1-yl)butyl]cyclopropanamine
CID 62437767
N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine
CID 62557293
N-[2-(4-cyclopropylpiperazin-1-yl)propyl]cyclopropanamine
CID 62411356
N-[2-(4-methylpiperazin-1-yl)propyl]cyclohexanamine
CID 62557467
N-[2-(4-tert-butylpiperazin-1-yl)propyl]cyclopropanamine
CID 55072104

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine?
The IUPAC name of N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine (CID 63625080) is N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine.
What is the SMILES notation for N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine?
The canonical SMILES for N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine is CC1CCCN(C(C)CNC2CC2)CC1.
What is the InChIKey of N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine?
The InChIKey is YEDCZDLBHJVADQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-11-4-3-8-15(9-7-11)12(2)10-14-13-5-6-13/h11-14H,3-10H2,1-2H3.
What are the key properties of N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine?
N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylazepan-1-yl)propyl]cyclopropanamine is sourced from PubChem (CID 63625080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).