(1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine

C16H26N4 — CID 103937123

IUPAC(1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine
SMILESCC[C@@H](N)c1ccc(N2CCN(CC3CC3)CC2)cn1
InChIInChI=1S/C16H26N4/c1-2-15(17)16-6-5-14(11-18-16)20-9-7-19(8-10-20)12-13-3-4-13/h5-6,11,13,15H,2-4,7-10,12,17H2,1H3/t15-/m1/s1
InChIKeyWQFJWTBHDLOSFK-OAHLLOKOSA-N
MW274.41 g/mol
LogP2.02
Rot. Bonds5

About (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine

(1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine (PubChem CID 103937123) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound Name(1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine
PubChem CID103937123
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC Name(1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine
SMILESCC[C@@H](N)c1ccc(N2CCN(CC3CC3)CC2)cn1
InChIInChI=1S/C16H26N4/c1-2-15(17)16-6-5-14(11-18-16)20-9-7-19(8-10-20)12-13-3-4-13/h5-6,11,13,15H,2-4,7-10,12,17H2,1H3/t15-/m1/s1
InChIKeyWQFJWTBHDLOSFK-OAHLLOKOSA-N
XLogP2.02
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-1-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]propan-1-amine
CID 113355072
(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine
CID 103936871
1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]piperidin-4-ol
CID 103936925
1-[1-[6-(1-aminopropyl)-3-pyridinyl]piperidin-4-yl]ethanol
CID 106836278
1-[4-[6-[(1R)-1-aminopropyl]-3-pyridinyl]piperazin-1-yl]-2-methylpropan-2-ol
CID 103937415
1-[5-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2-pyridinyl]propan-1-amine
CID 115939557
[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]piperidin-3-yl]methanol
CID 103937018
1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 112584254
1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-one
CID 115938950
(1S)-1-[5-(3,4-dimethylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 113355142
N-[[1-[6-[(1S)-1-aminopropyl]-3-pyridinyl]piperidin-4-yl]methyl]acetamide
CID 102736474
1-[5-(1-oxo-1,4-thiazinan-4-yl)-2-pyridinyl]propan-1-amine
CID 112584315

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine?
The IUPAC name of (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine (CID 103937123) is (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine.
What is the SMILES notation for (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine?
The canonical SMILES for (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine is CC[C@@H](N)c1ccc(N2CCN(CC3CC3)CC2)cn1.
What is the InChIKey of (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine?
The InChIKey is WQFJWTBHDLOSFK-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H26N4/c1-2-15(17)16-6-5-14(11-18-16)20-9-7-19(8-10-20)12-13-3-4-13/h5-6,11,13,15H,2-4,7-10,12,17H2,1H3/t15-/m1/s1.
What are the key properties of (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine?
(1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine has a molecular weight of 274.41 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-[4-(cyclopropylmethyl)piperazin-1-yl]-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 103937123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).