N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine

C15H30N2 — CID 62212523

IUPACN-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine
SMILESCCCCN(CCCC1CCNCC1)C1CC1
InChIInChI=1S/C15H30N2/c1-2-3-12-17(15-6-7-15)13-4-5-14-8-10-16-11-9-14/h14-16H,2-13H2,1H3
InChIKeyYENPKSKYYWFITC-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds8

About N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine

N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine (PubChem CID 62212523) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine.

Molecular Properties

Compound NameN-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine
PubChem CID62212523
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine
SMILESCCCCN(CCCC1CCNCC1)C1CC1
InChIInChI=1S/C15H30N2/c1-2-3-12-17(15-6-7-15)13-4-5-14-8-10-16-11-9-14/h14-16H,2-13H2,1H3
InChIKeyYENPKSKYYWFITC-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,4-dimethyl-N-(3-piperidin-4-ylpropyl)cyclohexan-1-amine
CID 62212511
4-hexadecylpiperidine
CID 54096875
4-heptylpiperidine;methane
CID 144690559
4-butylpiperidine;formonitrile
CID 142168007
N-butyl-N-cyclopropyl-3-piperidin-4-ylpropanamide
CID 62210210
N'-butyl-N'-cyclopropylethane-1,2-diamine
CID 61349574
3-[butyl(cyclopropyl)amino]propan-1-ol
CID 60969534
N,N-diethyl-4-piperidin-4-ylbutan-1-amine
CID 10081918
4-butylpiperidine;isocyanic acid
CID 175010642
ethane;4-propylpiperidine
CID 142071399
N-butyl-N-(piperidin-4-ylmethyl)pentan-1-amine
CID 94810456
4-pentylazecane
CID 166829392

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine?
The IUPAC name of N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine (CID 62212523) is N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine.
What is the SMILES notation for N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine?
The canonical SMILES for N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine is CCCCN(CCCC1CCNCC1)C1CC1.
What is the InChIKey of N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine?
The InChIKey is YENPKSKYYWFITC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-2-3-12-17(15-6-7-15)13-4-5-14-8-10-16-11-9-14/h14-16H,2-13H2,1H3.
What are the key properties of N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine?
N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine is sourced from PubChem (CID 62212523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).