N-benzyl-N,1-dipropylcyclopropan-1-amine

C16H25N — CID 90378697

IUPACN-benzyl-N,1-dipropylcyclopropan-1-amine
SMILESCCCN(Cc1ccccc1)C1(CCC)CC1
InChIInChI=1S/C16H25N/c1-3-10-16(11-12-16)17(13-4-2)14-15-8-6-5-7-9-15/h5-9H,3-4,10-14H2,1-2H3
InChIKeySWPGGKRQDLJUTH-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.23
Rot. Bonds7

About N-benzyl-N,1-dipropylcyclopropan-1-amine

N-benzyl-N,1-dipropylcyclopropan-1-amine (PubChem CID 90378697) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is N-benzyl-N,1-dipropylcyclopropan-1-amine.

Molecular Properties

Compound NameN-benzyl-N,1-dipropylcyclopropan-1-amine
PubChem CID90378697
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC NameN-benzyl-N,1-dipropylcyclopropan-1-amine
SMILESCCCN(Cc1ccccc1)C1(CCC)CC1
InChIInChI=1S/C16H25N/c1-3-10-16(11-12-16)17(13-4-2)14-15-8-6-5-7-9-15/h5-9H,3-4,10-14H2,1-2H3
InChIKeySWPGGKRQDLJUTH-UHFFFAOYSA-N
XLogP4.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N,1-dipropylcyclopropan-1-amine?
The IUPAC name of N-benzyl-N,1-dipropylcyclopropan-1-amine (CID 90378697) is N-benzyl-N,1-dipropylcyclopropan-1-amine.
What is the SMILES notation for N-benzyl-N,1-dipropylcyclopropan-1-amine?
The canonical SMILES for N-benzyl-N,1-dipropylcyclopropan-1-amine is CCCN(Cc1ccccc1)C1(CCC)CC1.
What is the InChIKey of N-benzyl-N,1-dipropylcyclopropan-1-amine?
The InChIKey is SWPGGKRQDLJUTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-3-10-16(11-12-16)17(13-4-2)14-15-8-6-5-7-9-15/h5-9H,3-4,10-14H2,1-2H3.
What are the key properties of N-benzyl-N,1-dipropylcyclopropan-1-amine?
N-benzyl-N,1-dipropylcyclopropan-1-amine has a molecular weight of 231.38 g/mol, XLogP of 4.23, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N,1-dipropylcyclopropan-1-amine is sourced from PubChem (CID 90378697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).