N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine

C14H28N2 — CID 115709211

IUPACN-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine
SMILESCCC(NCC(CC)N1CCCC1)C1CC1
InChIInChI=1S/C14H28N2/c1-3-13(16-9-5-6-10-16)11-15-14(4-2)12-7-8-12/h12-15H,3-11H2,1-2H3
InChIKeyYCCFGZRTLGIMNL-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds7

About N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine

N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine (PubChem CID 115709211) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine.

Molecular Properties

Compound NameN-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine
PubChem CID115709211
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine
SMILESCCC(NCC(CC)N1CCCC1)C1CC1
InChIInChI=1S/C14H28N2/c1-3-13(16-9-5-6-10-16)11-15-14(4-2)12-7-8-12/h12-15H,3-11H2,1-2H3
InChIKeyYCCFGZRTLGIMNL-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclopropylpropan-2-yl)-2-pyrrolidin-1-ylbutan-1-amine
CID 115709200
N-(1-cyclopropylpropyl)-4-methyl-2-morpholin-4-ylpentan-1-amine
CID 64919676
3-methyl-N-(2-pyrrolidin-1-ylbutyl)butan-2-amine
CID 115709196
N-(1-cyclopropylpropyl)-2-methyl-3-piperidin-1-ylpropan-1-amine
CID 64918005
3-methyl-N-(2-pyrrolidin-1-ylbutyl)pentan-2-amine
CID 115709194
N-[2-(azocan-1-yl)butyl]cyclopropanamine
CID 62419227
N-(1-cyclopropylpropyl)piperidin-1-amine
CID 83006384
2-(azepan-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 62437423
3-[(1-cyclopropylpropylamino)methyl]-5-methylhexan-1-ol
CID 115726083
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
5-(1-cyclopropylpropylamino)-4-methylpentan-2-ol
CID 115722950
N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine
CID 79692352

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine?
The IUPAC name of N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine (CID 115709211) is N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine.
What is the SMILES notation for N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine?
The canonical SMILES for N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine is CCC(NCC(CC)N1CCCC1)C1CC1.
What is the InChIKey of N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine?
The InChIKey is YCCFGZRTLGIMNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-13(16-9-5-6-10-16)11-15-14(4-2)12-7-8-12/h12-15H,3-11H2,1-2H3.
What are the key properties of N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine?
N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropyl)-2-pyrrolidin-1-ylbutan-1-amine is sourced from PubChem (CID 115709211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).